SCHEMBL5082157

SCHEMBL5082157

Cc1cc(-c2cccs2)nc2cc(Nc3nccn4c(C5CC(CN(C)C)C5)ncc34)ccc12

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.38
CYP3A4 P08684 1/20 0.38
TNK2 Q07912 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MCHR1 Q99705 1/20 0.31
SRC P12931 1/20 0.31
PDGFRB P09619 1/20 0.30
KIT P10721 1/20 0.30
FLT3 P36888 1/20 0.30
PRKDC P78527 1/20 0.30

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
SCHEMBL5083767 0.90 IGF1R (0.46) IGF1RCYP3A4TNK2NPC1RAB9A
SCHEMBL5080265 0.89 RAB9A (0.35) IGF1RCYP3A4TNK2NPC1RAB9A
SCHEMBL5083969 0.88 IGF1R (0.46) IGF1RCYP3A4TNK2
SCHEMBL5081269 0.87 CYP3A4 (0.39) IGF1RCYP3A4TNK2
SCHEMBL5085063 0.82 IGF1R (0.42) IGF1RCYP3A4TNK2
SCHEMBL5085497 0.81 TNK2 (0.44) IGF1RCYP3A4TNK2MCHR1
SCHEMBL5258044 0.79 IGF1R (0.58) IGF1RCYP3A4TNK2FLT3
SCHEMBL5084929 0.78 IGF1R (0.47) IGF1RCYP3A4TNK2NPC1RAB9A
SCHEMBL5083550 0.77 IGF1R (0.40) IGF1RCYP3A4TNK2NPC1RAB9A
SCHEMBL399308 0.76 IGF1R (0.67) IGF1RCYP3A4TNK2

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-1979002-A2 COMBINATION OF IGFR INHIBITOR AND ANTI-CANCER AGENT OSI Pharmaceuticals, Inc. (US) 2008-10-15 EP disclosed
WO-2008076143-A1 COMBINATION OF IGFR INHIBITOR AND ANTI-CANCER AGENT OSI PHARMACEUTICALS, INC. (US) 2008-06-26 WO disclosed
WO-2007075554-A2 COMBINATION OF IGFR INHIBITOR AND ANTI-CANCER AGENT OSI PHARMACEUTICALS, INC. (US) 2007-07-05 WO disclosed