SCHEMBL3894571

SCHEMBL3894571

O=C(O)c1sc(Cl)nc1-c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.68
GAA P10253 1/20 0.59
HTT P42858 1/20 0.59
NPSR1 Q6W5P4 3/20 0.58
RXFP1 Q9HBX9 1/20 0.58
CDC7 O00311 2/20 0.58
DBF4 Q9UBU7 2/20 0.58
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
HPGD P15428 2/20 0.50
TSHR P16473 1/20 0.50
ADAMTS5 Q9UNA0 1/20 0.46
NR4A2 P43354 1/20 0.45
CCNE1 P24864 1/20 0.44
CDK2 P24941 1/20 0.44
ADORA3 P0DMS8 2/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
ADORA2B P29275 1/20 0.43

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
SCHEMBL11287248 0.88 ALDH1A1 (0.66) ALDH1A1GAAHTTNPSR1RXFP1
SCHEMBL11286855 0.88 SMN1; SMN2 (0.54) ALDH1A1GAAHTTNPSR1RXFP1
SCHEMBL11278098 0.82 LMNA (0.64) ALDH1A1GAAHTTNPSR1RXFP1
SCHEMBL5816209 0.80 CDC7 (0.59) ALDH1A1CDC7DBF4SMN1; SMN2HPGD
SCHEMBL974859 0.80 CDC7 (0.84) ALDH1A1GAANPSR1CDC7DBF4
SCHEMBL5760659 0.80 CDC7 (0.59) ALDH1A1CDC7DBF4SMN1; SMN2HPGD
SCHEMBL11292190 0.80 ALDH1A1 (0.58) ALDH1A1NPSR1RXFP1LMNASMN1; SMN2
SCHEMBL6285875 0.80 FNTA (0.47) ALDH1A1GAAHTTNPSR1RXFP1
SCHEMBL4485015 0.79 CDC7 (0.71) ALDH1A1CDC7DBF4LMNASMN1; SMN2
SCHEMBL11279454 0.79 ALDH1A1 (0.59) ALDH1A1GAAHTTNPSR1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101415704-A 4-phenyl-thiazole-5-carboxylic acids and 4-phenyl-thiazole-5-carboxylic acid amides as PLK1 inhibitors HOFFMANN LA ROCHE (CH) 2009-04-22 CN disclosed
US-7504513-B2 Thiazolyl-benzimidazoles HOFFMAN-LA ROCHE INC. (US) 2009-03-17 US disclosed
EP-1991543-A1 4-PHENYL-THIAZOLE-5-CARBOXYLIC ACIDS AND 4-PHENYL-THIAZOLE-5-CARBOXYLIC ACID AMIDES AS PLK1 INHIBITORS F. Hoffmann-La Roche AG (CH) 2008-11-19 EP disclosed
CN-101304985-A Thiazole compounds and their use as PGDs2AntagonistsUse of ARGENTA DISCOVERY LTD (GB) 2008-11-12 CN disclosed
WO-2007096315-A1 4-PHENYL-THIAZOLE-5-CARBOXYLIC ACIDS AND 4-PHENYL-THIAZOLE-5-CARBOXYLIC ACID AMIDES AS PLK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-08-30 WO disclosed
US-20070203210-A1 Thiazolyl-benzimidazoles BOYLAN JOHN FREDERICK 2007-08-30 US disclosed
US-4336389-A 2-Substituted-4-aryl-5-thiazolecarboxylic acids and their derivatives as safening agents MONSANTO COMPANY (US) 1982-06-22 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 (1 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-20070203210-A1 Thiazolyl-benzimidazoles CYP3A7, CYP2C19, CYP3A5 ALDH1A1 100/4885GAA 168/4885HTT 1345/4885

“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.