SCHEMBL20113709

SCHEMBL20113709

CCCc1cnc(C=O)c(N2CCOCC2=O)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 2/20 0.36
MAP4K1 Q92918 5/20 0.34
LRRK2 Q5S007 1/20 0.32
MET P08581 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
F10 P00742 3/20 0.31
NTRK1 P04629 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
MTOR P42345 1/20 0.30
PTGS2 P35354 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 0.66 FFAR4 (0.33) KDM4ENPC1RAB9A
SCHEMBL17232467 0.66 MAP4K1 (0.44) MAP4K1F10MTORPTGS2
SCHEMBL20113780 0.66 FGFR4 (0.32) FGFR4
SCHEMBL20113656 0.65 HTR2A (0.34) KDM4ENPC1RAB9A
SCHEMBL20113643 0.63 KDM4E (0.37) FGFR4KDM4ENPC1RAB9A
SCHEMBL15616611 0.62 PTGS2 (0.39) MAP4K1LRRK2KDM4EF10PIK3CD
SCHEMBL8285966 0.61 PTGS2 (0.45) MAP4K1F10PIK3CDPIK3CAPIK3CB
SCHEMBL20113660 0.61 NPC1 (0.31) NPC1RAB9A
SCHEMBL17229320 0.61 ALDH1A1 (0.41) MAP4K1LRRK2NPC1RAB9AF10
SCHEMBL7906874 0.60 F10 (0.53) F10PTGS2

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