SCHEMBL5766356

SCHEMBL5766356

COCCOc1ccc2c(c1)ncn2-c1ccc2cc(-c3ccc(OC)nc3)ccc2n1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.40
PIK3CD O00329 2/20 0.40
PIK3CB P42338 1/20 0.40
PI4KA P42356 1/20 0.40
PIK3CG P48736 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
FGFR1 P11362 8/20 0.40
MTOR P42345 2/20 0.40
SRC P12931 3/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
KDR P35968 2/20 0.39
BRAF P15056 2/20 0.39
ATM Q13315 3/20 0.39

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
SCHEMBL5766459 0.86 CYP11B2 (0.47) PIK3CDFGFR1SRCKDRBRAF
SCHEMBL5767029 0.85 MIF (0.48) FGFR1SRCKDRBRAF
SCHEMBL5765733 0.84 IRAK4 (0.41) PIK3CAFGFR1MTORSRCPDGFRB
SCHEMBL5767404 0.84 FGFR1 (0.42) FGFR1SRCPDGFRBPDGFRAKDR
SCHEMBL5766820 0.84 FGFR1 (0.54) FGFR1SRCKDRBRAFATM
SCHEMBL5767448 0.82 FGFR1 (0.45) FGFR1SRCKDRBRAFATM
SCHEMBL5767045 0.82 BRAF (0.39) FGFR1SRCKDRBRAF
SCHEMBL5764733 0.80 KDR (0.45) FGFR1SRCKDR
SCHEMBL31060334 0.80 FGFR1 (0.52) FGFR1SRCPDGFRBPDGFRA
SCHEMBL5765191 0.79 MIF (0.39) FGFR1SRCPDGFRBPDGFRA

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
EP-1235825-B1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PROD INC (US) 2006-01-25 EP claimed