SCHEMBL1871196

SCHEMBL1871196

COc1cc(CCc2cc(-c3cc(F)ccc3C(N)=O)[nH]n2)cc(OC)c1.COc1cc(CCc2cc(NC(=O)c3ccc(N4CCNC(C)(C)C4)cc3)[nH]n2)cc(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 3/20 0.43
FGFR1 P11362 5/20 0.43
AURKB Q96GD4 3/20 0.43
NTRK1 P04629 1/20 0.43
RET P07949 1/20 0.43
PDGFRB P09619 1/20 0.43
MARK3 P27448 1/20 0.43
TNK2 Q07912 1/20 0.43
DDR1 Q08345 1/20 0.43
MAP4K2 Q12851 1/20 0.43
MAP3K11 Q16584 1/20 0.43
DDR2 Q16832 1/20 0.43
MARK2 Q7KZI7 1/20 0.43
MAP4K3 Q8IVH8 1/20 0.43
MAP4K1 Q92918 1/20 0.43
EIF2AK1 Q9BQI3 1/20 0.43
MAP3K20 Q9NYL2 1/20 0.43
STK26 Q9P289 1/20 0.43
TNIK Q9UKE5 1/20 0.43
MAP4K5 Q9Y4K4 1/20 0.43

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
SCHEMBL64439 0.88 FGFR1 (0.51) FGFR2FGFR1AURKBNTRK1RET
SCHEMBL4438354 0.78 FGFR3 (0.38) FGFR2FGFR1AURKBNTRK1RET
SCHEMBL63441 0.76 FGFR1 (0.52) FGFR1AURKBNTRK1RETPDGFRB
SCHEMBL65154 0.75 FGFR1 (0.50) FGFR2FGFR1AURKBNTRK1RET
SCHEMBL63601 0.75 FGFR1 (0.50) FGFR2FGFR1AURKBNTRK1RET
SCHEMBL29688533 0.74 FGFR1 (0.54) FGFR2FGFR1AURKBNTRK1RET
SCHEMBL64111 0.74 FGFR1 (0.56) FGFR2FGFR1AURKBNTRK1RET
SCHEMBL64062 0.74 FGFR1 (0.55) FGFR2FGFR1AURKBNTRK1RET
SCHEMBL63681 0.74 FGFR2 (0.45) FGFR2FGFR1AURKBNTRK1RET
SCHEMBL65013 0.73 FGFR1 (0.54) FGFR2FGFR1AURKBNTRK1RET

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-2125748-B1 ACYLAMINOPYRAZOLES AS FGFR INHIBITORS ASTRAZENECA AB (SE) 2011-05-25 EP disclosed