SCHEMBL1722906

SCHEMBL1722906

[CH2]c1csc(-c2cccnc2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 8/20 0.67
AXL P30530 1/20 0.67
PBRM1 Q86U86 1/20 0.67
MKNK1 Q9BUB5 1/20 0.67
MKNK2 Q9HBH9 1/20 0.67
CYP2E1 P05181 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2A6 P11509 1/20 0.65
CYP2C9 P11712 1/20 0.65
CYP2B6 P20813 1/20 0.65
KDM4E B2RXH2 4/20 0.63
RAB9A P51151 3/20 0.63
ALDH1A1 P00352 2/20 0.63
NPC1 O15118 2/20 0.58
HSD17B10 Q99714 2/20 0.56
MAPK1 P28482 2/20 0.56
MAPT P10636 2/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
HPGD P15428 1/20 0.55

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
SCHEMBL6196239 0.80 CYP19A1 (1.00) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL95516 0.79 KDM4E (0.53) CYP19A1CYP3A4CYP2C9KDM4ERAB9A
SCHEMBL9829144 0.79 CYP19A1 (0.67) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL289794 0.79 CYP19A1 (0.67) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL12402375 0.79 CYP19A1 (0.67) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL14359963 0.79 CYP19A1 (0.67) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL266591 0.79 CYP2E1 (1.00) CYP19A1AXLPBRM1MKNK1MKNK2
Bromide SCHEMBL10437007 0.77 CYP19A1 (0.65) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL6649362 0.77 CYP19A1 (0.87) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL7495850 0.77 RAB9A (1.00) CYP19A1AXLPBRM1MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344486-B1 ALKYLTHIAZOL CARBAMATE DERIVATIVES, PREPARATION THEREOF AND THEIR USE AS FAAH INHIBITORS SANOFI SA (FR) 2013-03-27 EP disclosed
EP-2344486-A2 ALKYLTHIAZOL CARBAMATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2011-07-20 EP disclosed
WO-2010010288-A2 ALKYLTHIAZOL CARBAMATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-01-28 WO disclosed