SCHEMBL20113637

SCHEMBL20113637

CCCc1cc(C)c(C=O)nc1C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 1/20 0.32
KCNJ1 P48048 1/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 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
SCHEMBL20113675 0.84 ALDH1A1 (0.34) GRM1
SCHEMBL20113671 0.83 GLP1R (0.33) GRM1
SCHEMBL20113649 0.81 MEN1 (0.37) GRM1
SCHEMBL20113662 0.77
SCHEMBL17408855 0.74 BCHE (0.37) KCNJ1NOS3NOS1NOS2
SCHEMBL20113696 0.72 MEN1 (0.36) NOS2
SCHEMBL9846251 0.70 GRM1 (0.37) GRM1
SCHEMBL24771606 0.69 LMNA (0.34) KCNJ1
SCHEMBL30786784 0.69 LMNA (0.34) KCNJ1
SCHEMBL20113706 0.69 FGFR4 (0.35) GRM1

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