SCHEMBL628884

SCHEMBL628884

Cc1ccc(S(=O)(=O)Nc2ccc(C=CC(=O)Nc3ccccc3N)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 18/20 1.00
HDAC4 P56524 6/20 0.67
HDAC8 Q9BY41 5/20 0.67
MEN1 O00255 1/20 0.61
MAPT P10636 1/20 0.61
KMT2A Q03164 1/20 0.61
HDAC3 O15379 4/20 0.57
HDAC7 Q8WUI4 4/20 0.57
HDAC2 Q92769 4/20 0.57
HDAC10 Q969S8 4/20 0.57
HDAC11 Q96DB2 4/20 0.57
HDAC6 Q9UBN7 4/20 0.57
HDAC9 Q9UKV0 4/20 0.57
HDAC5 Q9UQL6 4/20 0.57

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
SCHEMBL5048820 1.00 HDAC1 (1.00) HDAC1HDAC4HDAC8MEN1MAPT
SCHEMBL5020638 1.00 HDAC1 (1.00) HDAC1HDAC4HDAC8MEN1MAPT
SCHEMBL6749952 1.00 HDAC1 (1.00) HDAC1HDAC4HDAC8MEN1MAPT
SCHEMBL13776415 0.91 HDAC1 (0.87) HDAC1HDAC4HDAC8HDAC3HDAC7
SCHEMBL14188745 0.89 HDAC1 (0.80) HDAC1HDAC4HDAC8MEN1MAPT
SCHEMBL5020640 0.89 HDAC1 (1.00) HDAC1HDAC4HDAC8HDAC3HDAC7
SCHEMBL5046654 0.89 HDAC1 (1.00) HDAC1HDAC4HDAC8HDAC3HDAC7
SCHEMBL14188338 0.89 HDAC1 (0.79) HDAC1HDAC4HDAC8HDAC3HDAC7
SCHEMBL5047304 0.89 HDAC1 (1.00) HDAC1HDAC4HDAC8HDAC3HDAC7
SCHEMBL5020771 0.89 HDAC1 (0.79) HDAC1HDAC4HDAC8HDAC3HDAC7

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040072770-A1 Methods for specifically inhibiting histone deacetylase-7 and 8 METHYLGENE, INC. (CA) 2004-04-15 US claimed
US-20240325398-A1 COMBINATION THERAPIES INFINITY PHARMACEUTICALS, INC. 2024-10-03 US disclosed
US-20200338083-A1 COMBINATION THERAPIES INFINITY PHARMACEUTICALS, INC. 2020-10-29 US disclosed
US-20170348314-A1 COMBINATION THERAPIES HCR COLLATERAL MANAGEMENT, LLC 2017-12-07 US disclosed
US-20150320754-A1 COMBINATION THERAPIES INFINITY PHARMACEUTICALS, INC. 2015-11-12 US disclosed
US-9115345-B2 MicroRNA induction of pluripotential stem cells and uses thereof THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2015-08-25 US disclosed
US-20130035374-A1 MicroRNA induction of pluripotential stem cells and uses thereof THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2013-02-07 US disclosed
EP-2419737-A2 HISTONE MODIFICATION PATTERNS FOR CLINICAL DIAGNOSIS AND PROGNOSIS OF CANCER The Regents of the University of California (US) 2012-02-22 EP disclosed
WO-2011133288-A9 MICRORNA INDUCTION OF PLURIPOTENTIAL STEM CELLS AND USES THEREOF THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-12-22 WO disclosed
WO-2011133288-A1 MICRORNA INDUCTION OF PLURIPOTENTIAL STEM CELLS AND USES THEREOF THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-10-27 WO disclosed
WO-2010120942-A2 HISTONE MODIFICATION PATTERNS FOR CLINICAL DIAGNOSIS AND PROGNOSIS OF CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-10-21 WO disclosed
US-20040072770-A1 Methods for specifically inhibiting histone deacetylase-7 and 8 METHYLGENE, INC. (CA) 2004-04-15 US 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 (5 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-20200338083-A1 COMBINATION THERAPIES HDAC1, HDAC4, HDAC2 HDAC1 1/4885HDAC4 2/4885HDAC8 9/4885
US-20150320754-A1 COMBINATION THERAPIES HDAC1, HDAC4, HDAC2 HDAC1 1/4885HDAC4 2/4885HDAC8 9/4885
US-20170348314-A1 COMBINATION THERAPIES HDAC1, HDAC4, HDAC2 HDAC1 1/4885HDAC4 2/4885HDAC8 9/4885
US-20240325398-A1 COMBINATION THERAPIES HDAC1, HDAC4, HDAC2 HDAC1 1/4885HDAC4 2/4885HDAC8 9/4885
US-20040072770-A1 Methods for specifically inhibiting histone deacetylase-7 and 8 HDAC8, HDAC7, HDAC1 HDAC1 3/4885HDAC4 10/4885HDAC8 1/4885

“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.