SCHEMBL20113083

SCHEMBL20113083

O=C(NCc1ccc(F)cc1F)C1c2ccccc2CC(=O)N1CC1CC1

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 1/20 0.82
P2RX7 Q99572 16/20 0.46
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX2 P34913 1/20 0.40

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
SCHEMBL20112955 0.90 GRM7 (1.00) GRM7P2RX7
SCHEMBL20113104 0.86 GRM7 (0.74) GRM7MEN1NPC1KMT2A
SCHEMBL20113106 0.86 GRM7 (0.74) GRM7MEN1NPC1KMT2A
SCHEMBL20113080 0.83 GRM7 (0.74) GRM7P2RX7MEN1RAB9AKMT2A
SCHEMBL20113021 0.82 GRM7 (0.78) GRM7P2RX7MEN1KMT2AEPHX2
SCHEMBL20113084 0.80 GRM7 (0.66) GRM7MEN1KMT2A
SCHEMBL20113026 0.80 GRM7 (0.74) GRM7P2RX7MEN1NPC1RAB9A
SCHEMBL20113019 0.78 GRM7 (0.68) GRM7KMT2A
SCHEMBL20113020 0.78 GRM7 (0.68) GRM7NPC1KMT2A
SCHEMBL20113103 0.78 GRM7 (0.65) GRM7P2RX7MEN1KMT2A

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
WO-2018079862-A1 MGLUR7 MODULATORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-03 WO disclosed