SCHEMBL21252510

SCHEMBL21252510

COc1cc(OC)cc(-c2cc3cnc(N)nc3c(NCCN3CCN(C)CC3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 9/20 0.49
FGFR2 P21802 8/20 0.49
FGFR4 P22455 8/20 0.49
FGFR3 P22607 8/20 0.49
KDR P35968 7/20 0.49
PGK1 P00558 2/20 0.42
FLT1 P17948 5/20 0.41
FLT4 P35916 5/20 0.41
TLR9 Q9NR96 2/20 0.39
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
ALOX15 P16050 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HRH4 Q9H3N8 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
SCHEMBL21240105 0.87 FGFR4 (0.43) FGFR1FGFR2FGFR4FGFR3KDR
SCHEMBL29578853 0.87 FGFR4 (0.43) FGFR1FGFR2FGFR4FGFR3KDR
SCHEMBL20330753 0.82 PGK1 (0.46) FGFR1FGFR2FGFR3KDRPGK1
SCHEMBL20331085 0.82 PGK1 (0.45) FGFR1FGFR2FGFR4FGFR3KDR
SCHEMBL21251983 0.80 PGK1 (0.43) FGFR1PGK1TLR9LMNACYP1A2
SCHEMBL20331048 0.79 FGFR1 (0.41) FGFR1FGFR2FGFR4FGFR3KDR
SCHEMBL21251985 0.78 PGK1 (0.41) FGFR1KDRPGK1TLR9LMNA
SCHEMBL21321086 0.75 FGFR2 (0.42) FGFR1FGFR2FGFR4FGFR3KDR
SCHEMBL21240387 0.74 FGFR4 (0.56) FGFR1FGFR2FGFR4FGFR3KDR
SCHEMBL29577775 0.74 FGFR4 (0.56) FGFR1FGFR2FGFR4FGFR3KDR

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-3524603-A1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2019-08-14 EP disclosed