SCHEMBL23320538

SCHEMBL23320538

Cn1cc(-c2nc3ccc(N(CCc4ccncc4)C(N)=O)cc3o2)cn1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 5/20 0.41
▸ FGFR4 P22455 5/20 0.41
▸ FGFR3 P22607 5/20 0.41
▸ KDR P35968 5/20 0.41
▸ FGFR2 P21802 4/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ MET P08581 3/20 0.40
▸ WNT1 P04628 2/20 0.39
▸ GSK3B P49841 2/20 0.39
▸ DYRK1A Q13627 2/20 0.39
▸ PIM1 P11309 1/20 0.38
▸ PIM2 Q9P1W9 1/20 0.38
▸ NAMPT P43490 3/20 0.37
▸ MST1R Q04912 1/20 0.35
▸ GRM2 Q14416 4/20 0.34
▸ MKNK1 Q9BUB5 1/20 0.34
▸ MKNK2 Q9HBH9 1/20 0.34
▸ CCNC P24863 1/20 0.34
▸ CDK8 P49336 1/20 0.34

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
SCHEMBL27157147 0.91 FGFR1 (0.43) FGFR1FGFR4FGFR3KDRFGFR2
SCHEMBL23320537 0.79 MET (0.40) FGFR1FGFR4FGFR3KDRFGFR2
SCHEMBL23320510 0.73 NAMPT (0.71) NAMPT
SCHEMBL31344824 0.69 NPC1 (0.61) FLT3METPIM1PIM2
SCHEMBL23320475 0.66 CYP19A1 (0.40) GSK3B
SCHEMBL30943251 0.65 RAB9A (0.63) MET
SCHEMBL27157148 0.64 CASP3 (0.43) NAMPT
SCHEMBL29000685 0.64 MET (0.64) MET
SCHEMBL23320379 0.62 NAMPT (0.41) NAMPTMKNK1MKNK2
SCHEMBL23320493 0.62 ALDH1A1 (0.38) GSK3B

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-3818053-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-05-12 — — EP disclosed
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