SCHEMBL6058064

SCHEMBL6058064

Cc1cccc(Cl)c1NC(=O)c1ccc2nc(N)sc2c1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 19/20 0.71
FYN P06241 1/20 0.67
SRC P12931 1/20 0.67
ALDH1A1 P00352 1/20 0.65
TP53 P04637 1/20 0.65
HPGD P15428 1/20 0.65
HSD17B10 Q99714 1/20 0.65

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
SCHEMBL21709936 0.92 NPC1 (0.67) LCKFYNSRCALDH1A1TP53
SCHEMBL6058160 0.92 LCK (0.82) LCKALDH1A1TP53HPGDHSD17B10
SCHEMBL6058279 0.86 LCK (0.81) LCKFYNSRC
SCHEMBL7628467 0.84 LCK (0.67) LCKFYNSRC
SCHEMBL6057883 0.82 LCK (1.00) LCKALDH1A1TP53HPGDHSD17B10
SCHEMBL6058083 0.82 LCK (1.00) LCKFYNSRC
SCHEMBL6058145 0.82 LCK (0.86) LCKFYNSRC
SCHEMBL6057842 0.81 LCK (0.76) LCKFYNSRC
SCHEMBL6058036 0.81 LCK (1.00) LCKFYNSRC
SCHEMBL6057930 0.81 LCK (0.80) LCKFYNSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1037632-B1 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2006-01-11 EP disclosed
US-6825355-B2 FOR THERAPY OF IMMUNOLOGIC DISORDERS SUCH AS TRANSPLANT REJECTION, RHEUMATOID ARTHRITIS. MULTIPLE SCLEROSIS, INFLAMMATORY BOWEL DISEASE, LUPUS, GRAFT VS. HOST DISEASE BRISTOL-MYERS SQUIBB CO. 2004-11-30 US disclosed
EP-1037632-A4 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2002-08-21 EP disclosed
EP-1037632-A1 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-09-27 EP disclosed
WO-1999024035-A1 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-05-20 WO disclosed