SCHEMBL20113778

SCHEMBL20113778

CCCc1cnc(C=O)c(-c2cnc(C)s2)c1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.32
GRM2 Q14416 1/20 0.32
FGFR4 P22455 2/20 0.32
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
PIK3C3 Q8NEB9 1/20 0.31
KCNJ1 P48048 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL20113958 0.75 FFAR4 (0.33) KCNJ1
SCHEMBL13243592 0.70 GABRA1 (0.43) NPSR1
SCHEMBL20113660 0.69 NPC1 (0.31)
SCHEMBL20113643 0.68 KDM4E (0.37) FGFR4
SCHEMBL5527394 0.67 AOC3 (0.44) NPSR1
SCHEMBL20113656 0.67 HTR2A (0.34) NPSR1
SCHEMBL20114332 0.66 NPC1 (0.31) NPSR1
SCHEMBL20114328 0.65 SRC (0.38) FGFR4
SCHEMBL10442596 0.62 HCAR2 (0.46) PIK3CDPIK3CBPIK3CGPIK3C3NPSR1
SCHEMBL20113780 0.60 FGFR4 (0.32) FGFR4

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-3060563-B1 RING-FUSED BICYCLIC PYRIDYL DERIVATIVES AS FGFR4 INHIBITORS NOVARTIS AG (CH) 2018-05-02 EP disclosed