SCHEMBL8099705

SCHEMBL8099705

CN(c1ccccc1)S(=O)(=O)c1cccc(/C=C/C(=O)NO)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 17/20 1.00
HDAC6 Q9UBN7 16/20 1.00
HDAC8 Q9BY41 15/20 1.00
HDAC2 Q92769 15/20 1.00
HDAC3 O15379 13/20 1.00
HDAC4 P56524 13/20 1.00
HDAC7 Q8WUI4 12/20 1.00
HDAC9 Q9UKV0 12/20 1.00
HDAC5 Q9UQL6 12/20 1.00
HDAC10 Q969S8 11/20 1.00
HDAC11 Q96DB2 11/20 1.00
BRD4 O60885 1/20 0.61
ESR1 P03372 1/20 0.61
PTGS1 P23219 1/20 0.61
PDE4A P27815 1/20 0.61
PIK3CA P42336 1/20 0.61
HTR6 P50406 1/20 0.61
PDE4D Q08499 1/20 0.61
ASPH Q12797 1/20 0.61
GAA P10253 1/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8242414 0.88 HDAC1 (0.78) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL1402953 0.87 HDAC1 (0.77) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL1402955 0.87 HDAC1 (0.77) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL5020683 0.87 HDAC1 (1.00) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL1403166 0.85 HDAC1 (0.74) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL1403168 0.85 HDAC1 (0.74) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL1403297 0.85 HDAC1 (0.74) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL1402924 0.85 HDAC1 (0.74) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL1402923 0.85 HDAC1 (0.74) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL1403271 0.85 HDAC1 (0.73) HDAC1HDAC6HDAC8HDAC2HDAC3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210030899-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2021-02-04 US disclosed
US-10842891-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography THE GENERAL HOSPITAL CORPORATION (US) 2020-11-24 US disclosed
US-10799469-B2 Combination therapies using HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2020-10-13 US disclosed
US-20190240357-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2019-08-08 US disclosed
US-20190216755-A1 Combination Therapies Using HDAC Inhibitors TOPOTARGET UK LIMITED (GB) 2019-07-18 US disclosed
US-10285959-B2 Combination therapies using HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2019-05-14 US disclosed
US-10188756-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography THE GENERAL HOSPITAL CORPORATION (US) 2019-01-29 US disclosed
US-9980957-B2 Histone deacetylase (HDAC) inhibitors for the treatment of cancer TOPOTARGET UK LIMITED (GB) 2018-05-29 US disclosed
US-20170172997-A1 HISTONE DEACETYLASE (HDAC) INHIBITORS FOR THE TREATMENT OF CANCER TOPOTARGET UK LIMITED (GB) 2017-06-22 US disclosed
US-9603926-B2 Histone deacetylase (HDAC) inhibitors for the treatment of cancer TOPOTARGET UK LIMITED (GB) 2017-03-28 US disclosed
US-20080213399-A1 Histone deacetylase inhibitor, and epidermal growth factor receptor inhibitor; Cisplatin, 5-Fluorouracil, Oxaliplatin, Topotecan, Gemcitabine, Docetaxel, Doxorubicin, Tamoxifen, Dexamethasone, 5-Azacytidine, Chlorambucil, Fludarabine, Tarceva (reg) , Alimta (reg) , Melphalan TOPOTARGET UK LIMITED (GB) 2008-09-04 US disclosed
US-7407988-B2 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2008-08-05 US disclosed
US-7407988-B2 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2008-08-05 US disclosed
US-20080161401-A1 CARBAMIC ACID COMPOUNDS COMPRISING A SULFONAMIDE LINKAGE AS HDAC INHIBITORS TOPOTARGET UK LIMITED (GB) 2008-07-03 US disclosed
US-20080161401-A1 CARBAMIC ACID COMPOUNDS COMPRISING A SULFONAMIDE LINKAGE AS HDAC INHIBITORS TOPOTARGET UK LIMITED (GB) 2008-07-03 US disclosed
US-7183298-B2 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2007-02-27 US disclosed
US-7183298-B2 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2007-02-27 US disclosed
US-20070004806-A1 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2007-01-04 US disclosed
US-20070004806-A1 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2007-01-04 US disclosed
WO-2005105066-A2 HISTONE DEACETYLASES INHIBITORS AGAINST HYPERLIPIDAEMIAS, ATHEROSCLEROSIS, CARDIOVASCULAR DISEASES UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2005-11-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190240357-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC8 7/4885
US-10188756-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC8 7/4885
US-20070004806-A1 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 10/4885HDAC8 4/4885
US-20210030899-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC8 7/4885
US-20080161401-A1 CARBAMIC ACID COMPOUNDS COMPRISING A SULFONAMIDE LINKAGE AS HDAC INHIBITORS HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 10/4885HDAC8 4/4885
US-10285959-B2 Combination therapies using HDAC inhibitors HDAC4, HDAC6, HDAC9 HDAC1 4/4885HDAC6 2/4885HDAC8 7/4885
US-20190216755-A1 Combination Therapies Using HDAC Inhibitors HDAC4, HDAC6, HDAC9 HDAC1 4/4885HDAC6 2/4885HDAC8 7/4885
US-20080213399-A1 Histone deacetylase inhibitor, and epidermal growth factor receptor inhibitor; Cisplatin, 5-Fluorouracil, Oxaliplatin, Topotecan, Gemcitabine, Docetaxel, Doxorubicin, Tamoxifen, Dexamethasone, 5-Azacytidine, Chlorambucil, Fludarabine, Tarceva (reg) , Alimta (reg) , Melphalan BRDT, HDAC4, HDAC1 HDAC1 3/4885HDAC6 9/4885HDAC8 4/4885
US-20170172997-A1 HISTONE DEACETYLASE (HDAC) INHIBITORS FOR THE TREATMENT OF CANCER HDAC1, HDAC4, BRDT HDAC1 1/4885HDAC6 5/4885HDAC8 13/4885
US-10799469-B2 Combination therapies using HDAC inhibitors HDAC4, HDAC6, HDAC9 HDAC1 4/4885HDAC6 2/4885HDAC8 7/4885
US-10842891-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC8 7/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.