SCHEMBL15580262

SCHEMBL15580262

O=C(CCNC(=O)c1nc(-c2nccs2)sc1C1CC1)NO

nearest known ligand 0.88

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 19/20 0.88
HDAC3 O15379 19/20 0.88
HDAC6 Q9UBN7 17/20 0.88
HDAC4 P56524 4/20 0.86

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
SCHEMBL15580248 0.94 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC4
Bisthianostat SCHEMBL15580258 0.93 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC4
SCHEMBL15580212 0.92 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC4
SCHEMBL15580218 0.92 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC4
SCHEMBL15580205 0.92 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC4
SCHEMBL15580263 0.89 HDAC1 (0.77) HDAC1HDAC3HDAC6HDAC4
SCHEMBL19114209 0.88 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC4
SCHEMBL15580209 0.88 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC4
SCHEMBL21151217 0.86 HDAC1 (0.89) HDAC1HDAC3HDAC6HDAC4
SCHEMBL18508387 0.84 HDAC1 (0.81) HDAC1HDAC3HDAC6HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10766889-B2 Aryl-2,2′-tandem bisthiazole compound and preparation method and use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2020-09-08 US disclosed
US-20190211005-A1 ARYL-2,2'-TANDEM BISTHIAZOLE COMPOUND AND PREPARATION METHOD AND USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2019-07-11 US disclosed
EP-2708534-B1 THIAZOLE COMPOUND AND PREPARATION METHOD AND USE THEREOF SHANGHAI THEORION PHARMACEUTICAL CO LTD (CN) 2017-07-12 EP disclosed
US-9216962-B2 Thiazole compounds, methods for preparation and use thereof SHANGHAI PUYI CHEMICAL CO., LTD. (CN) 2015-12-22 US disclosed
US-20140148600-A1 THIAZOLE COMPOUNDS, METHODS FOR PREPARATION AND USE THEREOF SHANGHAI THEORION PHARMACEUTICAL CO., LTD. (CN) 2014-05-29 US disclosed
EP-2708534-A1 THIAZOLE COMPOUND AND PREPARATION METHOD AND USE THEREOF Shanghai Puyi Chemical Co., Ltd. (CN) 2014-03-19 EP 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 (3 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-10766889-B2 Aryl-2,2′-tandem bisthiazole compound and preparation method and use thereof HDAC2, HDAC5, HDAC1 HDAC1 3/4885HDAC3 8/4885HDAC6 6/4885
US-20140148600-A1 THIAZOLE COMPOUNDS, METHODS FOR PREPARATION AND USE THEREOF HDAC5, HDAC7, HDAC1 HDAC1 3/4885HDAC3 9/4885HDAC6 7/4885
US-20190211005-A1 ARYL-2,2'-TANDEM BISTHIAZOLE COMPOUND AND PREPARATION METHOD AND USE THEREOF HDAC2, HDAC5, HDAC1 HDAC1 3/4885HDAC3 8/4885HDAC6 6/4885

“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.