SCHEMBL6276191

SCHEMBL6276191

COc1cncc(Nc2nc(C)c(Cc3ccc(S(N)(=O)=O)cc3)s2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 4/20 0.41
PDE5A O76074 1/20 0.40
CA1 P00915 7/20 0.40
CA2 P00918 7/20 0.40
CA9 Q16790 6/20 0.40
AOC3 Q16853 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CA12 O43570 3/20 0.38
FYN P06241 1/20 0.37
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PIK3CG P48736 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL2396147 0.82 MEN1 (0.56) CDK2CA1CA2CA9MEN1
SCHEMBL22792359 0.75 CA1 (0.59) CA1CA2CA9CA12CA7
SCHEMBL2393257 0.73 MEN1 (0.43) MEN1KMT2AKDM4EMAPTPIK3CD
SCHEMBL6276205 0.71 MEN1 (0.41) MEN1KMT2AKDM4EMAPTPIK3CD
SCHEMBL2395156 0.70 CDK2 (0.59) CDK2MEN1KMT2AKDM4EPOLB
SCHEMBL6274171 0.68 PIK3CD (0.54) CDK2PDE5AMEN1KMT2AKDM4E
SCHEMBL2397546 0.68 PIK3C2G (0.47) MEN1KMT2APIK3CDPIK3CAPIK3CB
SCHEMBL4596247 0.65 PIK3CD (0.53) CDK2PDE5ACA1CA2CA9
SCHEMBL2394578 0.65 MEN1 (0.55) CDK2CA1CA2CA9MEN1
SCHEMBL6189377 0.65 MEN1 (0.49) CDK2CA1CA2CA9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608647-A1 5-PHENYLTHIAZOLE DERIVATIVES AND THEIR USE AS P13 KINASE INHIBITORS Novartis AG (CH) 2005-12-28 EP disclosed
WO-2004078754-A1 5-PHENYLTHIAZOLE DERIVATIVES AND THEIR USE AS P13 KINASE INHIBITORS NOVARTIS AG (CH) 2004-09-16 WO disclosed