SCHEMBL3433976

SCHEMBL3433976

N#Cc1ncc(F)cc1-n1c2ccccc2c2cccc(-c3cnc4ccccc4c3)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.40
PDGFRA P16234 2/20 0.40
MTOR P42345 5/20 0.38
PIK3CA P42336 5/20 0.38
PIK3CD O00329 3/20 0.38
BIRC5 O15392 1/20 0.38
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
PIK3CB P42338 2/20 0.36
PIK3CG P48736 2/20 0.36
PRKDC P78527 2/20 0.36
ATM Q13315 2/20 0.36
SERPINA2 P20848 1/20 0.36
ATR Q13535 2/20 0.35
ATRIP Q8WXE1 1/20 0.35
PIK3C2A O00443 2/20 0.35
PIK3C2B O00750 2/20 0.35
CHEK1 O14757 1/20 0.35
ABCB11 O95342 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
SCHEMBL3433972 0.90 PDGFRB (0.38) PDGFRBPDGFRAMTORPIK3CAPIK3CD
SCHEMBL2185317 0.87 PIK3CA (0.40) PDGFRBPDGFRAMTORPIK3CAPIK3CD
SCHEMBL2184974 0.78 PIK3CA (0.38) PDGFRBPDGFRAMTORPIK3CAPIK3CD
SCHEMBL2183124 0.77 BIRC5 (0.38) PDGFRBPDGFRAMTORPIK3CAPIK3CD
SCHEMBL2183658 0.75 PDGFRB (0.38) PDGFRBPDGFRAMTORPIK3CAPIK3CD
SCHEMBL2182391 0.74 PDGFRB (0.40) PDGFRBPDGFRAMTORPIK3CAPIK3CD
SCHEMBL2181737 0.72 CYP11B1 (0.42) PDGFRBPDGFRAMTORPIK3CAPIK3CD
SCHEMBL2181700 0.71 HSP90AA1 (0.34) PDGFRBPDGFRAHSP90AA1
SCHEMBL21927539 0.69 ALDH1A1 (0.40) ATMACVR1
SCHEMBL24323416 0.69 KDM4E (0.43) PIK3CDMAPTATM

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-2265598-A2 NOVEL HSP90 INHIBITORY CARBAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME, AND USE THEREOF Sanofi-Aventis (FR) 2010-12-29 EP disclosed
WO-2009122034-A2 NOVEL HSP90 INHIBITORY CARBAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME, AND USE THEREOF SANOFI-AVENTIS (FR) 2009-10-08 WO disclosed