SCHEMBL16806936

SCHEMBL16806936

CNCc1ccc(/C=C/C(=O)NO)cc1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 15/20 0.67
▸ HDAC3 O15379 14/20 0.67
▸ HDAC2 Q92769 12/20 0.67
▸ HDAC1 Q13547 12/20 0.67
▸ HDAC6 Q9UBN7 7/20 0.64
▸ MMP8 P22894 1/20 0.61
▸ HDAC4 P56524 4/20 0.57
▸ HDAC5 Q9UQL6 3/20 0.57
▸ HDAC7 Q8WUI4 2/20 0.57
▸ HDAC10 Q969S8 2/20 0.57
▸ HDAC11 Q96DB2 2/20 0.57
▸ HDAC9 Q9UKV0 2/20 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
SCHEMBL4575959 0.84 MMP8 (0.63) HDAC8HDAC3HDAC2HDAC1HDAC6
SCHEMBL4575956 0.84 MMP8 (0.63) HDAC8HDAC3HDAC2HDAC1HDAC6
Hydrochloric Acid SCHEMBL28379254 0.83 MMP8 (0.61) HDAC8HDAC3HDAC2HDAC1HDAC6
SCHEMBL8256427 0.82 HDAC3 (0.68) HDAC8HDAC3HDAC2HDAC1HDAC6
SCHEMBL30711975 0.81 HDAC8 (0.69) HDAC8HDAC3HDAC2HDAC1HDAC6
SCHEMBL15482231 0.81 HDAC3 (0.69) HDAC8HDAC3HDAC2HDAC1HDAC6
SCHEMBL18808354 0.81 CA12 (0.62) HDAC8HDAC3HDAC2HDAC1MMP8
SCHEMBL12425759 0.80 HDAC8 (0.90) HDAC8HDAC3HDAC2HDAC1HDAC6
SCHEMBL14244596 0.80 HDAC8 (0.90) HDAC8HDAC3HDAC2HDAC1HDAC6
SCHEMBL10077678 0.80 MMP8 (0.71) HDAC8HDAC3HDAC2HDAC1MMP8

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 8 patents. 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-20190240357-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2019-08-08 — — 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
WO-2017200966-A1 HISTONE DEACETYLASE 6 INHIBITORS AND USE THEREOF DCB-USA LLC (US) 2017-11-23 — — WO disclosed
US-20160271276-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2016-09-22 — — US disclosed
US-20160271276-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2016-09-22 — — US disclosed
WO-2015085860-A1 HETEROCYCLIC HYDROXAMIC ACID COMPOUND, AND PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF 广州康缔安生物科技有限公司 2015-06-18 — — 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 (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-20190240357-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 HDAC8 7/4885HDAC3 3/4885HDAC2 4/4885
US-10188756-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 HDAC8 7/4885HDAC3 3/4885HDAC2 4/4885
US-20210030899-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 HDAC8 7/4885HDAC3 3/4885HDAC2 4/4885
US-20160271276-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 HDAC8 7/4885HDAC3 3/4885HDAC2 4/4885
US-10842891-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 HDAC8 7/4885HDAC3 3/4885HDAC2 4/4885

“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.

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