SCHEMBL7844784

SCHEMBL7844784

Cc1ccccc1-c1sc(Cc2ccccc2)nc1-c1ccccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 6/20 0.44
NPC1 O15118 4/20 0.42
KDM4E B2RXH2 2/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MITF O75030 1/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
KMT2A Q03164 1/20 0.41
MAPK14 Q16539 1/20 0.40
DCTPP1 Q9H773 1/20 0.40
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
Bromide SCHEMBL9368207 0.84 TGFBR1 (0.43) TGFBR1NPC1KDM4ERAB9ASMN1; SMN2
SCHEMBL9367732 0.80 IDO1 (0.52) TGFBR1NPC1KDM4ERAB9ASMN1; SMN2
Bromide SCHEMBL9368482 0.80 TGFBR1 (0.49) TGFBR1NPC1KDM4ERAB9ASMN1; SMN2
Bromide SCHEMBL9368658 0.79 IDO1 (0.51) TGFBR1NPC1KDM4ERAB9ASMN1; SMN2
SCHEMBL9369073 0.70 HEXA (0.36) TGFBR1MAPK14
SCHEMBL9368791 0.70 MAPK14 (0.41) TGFBR1MAPK14
SCHEMBL9368470 0.70 TGFBR1 (0.46) TGFBR1NPC1KDM4ERAB9AMAPK14
SCHEMBL9368570 0.69 MAPK14 (0.47) TGFBR1NPC1KDM4EMAPK14ALDH1A1
Bromide SCHEMBL9376098 0.68 MAPK14 (0.46) TGFBR1NPC1KDM4EMAPK14ALDH1A1
SCHEMBL9367775 0.68 CYP1A2 (0.39) KDM4EMAPK14ALDH1A1

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
EP-0625151-A1 THIAZOLYL-PYRIDINE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1994-11-23 EP claimed
WO-1993015071-A1 THIAZOLYL-PYRIDINE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1993-08-05 WO claimed
EP-1125932-A2 Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 2001-08-22 EP disclosed
US-5668161-A Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 1997-09-16 US disclosed
EP-0772606-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed
EP-0625151-A1 THIAZOLYL-PYRIDINE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1994-11-23 EP disclosed
WO-1993015071-A1 THIAZOLYL-PYRIDINE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1993-08-05 WO disclosed