SCHEMBL9967472

SCHEMBL9967472

Cc1cccc(C(=O)Nc2ccc(C)c(Nc3cc(C(=O)N4CCC(N(C)C)C4)nn3-c3cc(NC4CC4)ncn3)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LYN P07948 8/20 0.47
LCK P06239 7/20 0.47
INSR P06213 6/20 0.47
SRC P12931 6/20 0.47
KDR P35968 6/20 0.47
HCK P08631 3/20 0.47
BRAF P15056 5/20 0.40
ABL1 P00519 5/20 0.39
PDGFRB P09619 3/20 0.39
KIT P10721 2/20 0.39
NTRK1 P04629 2/20 0.39
MAPK14 Q16539 3/20 0.37
BCR P11274 2/20 0.37
RIPK2 O43353 1/20 0.37
FYN P06241 1/20 0.37
RET P07949 1/20 0.37
ARAF P10398 1/20 0.37
NQO2 P16083 1/20 0.37
EPHA2 P29317 1/20 0.37
EPHB2 P29323 1/20 0.37

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
SCHEMBL3586049 0.92 LCK (0.56) LYNLCKINSRSRCKDR
SCHEMBL9970880 0.92 LCK (0.56) LYNLCKINSRSRCKDR
SCHEMBL9967469 0.88 INSR (0.47) LYNLCKINSRSRCKDR
SCHEMBL9967471 0.87 INSR (0.49) LYNLCKINSRSRCKDR
SCHEMBL13503060 0.86 LCK (0.47) LYNLCKINSRSRCKDR
SCHEMBL9967470 0.86 INSR (0.52) LYNLCKINSRSRCKDR
SCHEMBL9967453 0.86 INSR (0.51) LYNLCKINSRSRCKDR
SCHEMBL9967454 0.84 LCK (0.49) LYNLCKINSRSRCKDR
SCHEMBL9967455 0.83 LCK (0.51) LYNLCKINSRSRCKDR
SCHEMBL9967457 0.83 LCK (0.48) LYNLCKINSRSRCKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed