SCHEMBL23409093

SCHEMBL23409093

COc1cc(CCc2cc(C)n[nH]2)cc(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 12/20 0.52
FGFR1 P11362 10/20 0.52
FGFR3 P22607 6/20 0.52
DAO P14920 1/20 0.49
KDR P35968 5/20 0.45
IGF1R P08069 3/20 0.45
INSR P06213 1/20 0.45
CYP19A1 P11511 1/20 0.45
FGFR4 P22455 2/20 0.43
AKR1B1 P15121 1/20 0.42
CALM1 P0DP23 1/20 0.42
AURKA O14965 1/20 0.42
JAK2 O60674 1/20 0.42
PDGFRB P09619 1/20 0.42
FLT3 P36888 1/20 0.42

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
SCHEMBL1922681 0.82 CYP19A1 (0.51) FGFR2FGFR1FGFR3DAOKDR
SCHEMBL20227222 0.81 FGFR2 (0.50) FGFR2FGFR1FGFR3DAOKDR
SCHEMBL18053017 0.80 FGFR2 (0.49) FGFR2FGFR1FGFR3DAOKDR
SCHEMBL16070500 0.77 HCAR2 (0.62) FGFR2FGFR1FGFR3DAOFGFR4
SCHEMBL16070556 0.76 THRB (0.45) FGFR2FGFR1FGFR3DAOFGFR4
SCHEMBL9491787 0.75 CYP19A1 (0.68) FGFR1DAOKDRCYP19A1AKR1B1
SCHEMBL25068996 0.75 FGFR2 (0.46) FGFR2FGFR1FGFR3DAOKDR
SCHEMBL28233100 0.73 DAO (0.49) FGFR2FGFR1FGFR3DAOKDR
SCHEMBL3935675 0.73 FGFR2 (0.44) FGFR2FGFR1FGFR3DAOKDR
SCHEMBL20224131 0.72 DAO (0.52) FGFR2FGFR1FGFR3DAOKDR

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
WO-2021099842-A1 PENTAFLUOROBENZENESULFONAMIDE DERIVATIVES AND USES THEREOF 2692372 ONTARIO INC. (CA) 2021-05-27 WO disclosed