SCHEMBL6529211

SCHEMBL6529211

CON(C)C(=O)c1ccc2c(c1)[C@H](C)CN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.45
ESR2 Q92731 1/20 0.44
NR1H2 P55055 1/20 0.43
USP30 Q70CQ3 1/20 0.42
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL4937603 0.85 ESR2 (0.49) GPR119ESR2NR1H2USP30NPC1
SCHEMBL5077828 0.82 NR1H2 (0.62) GPR119ESR2NR1H2USP30NPC1
SCHEMBL1365223 0.82 ESR2 (0.63) GPR119ESR2NR1H2
SCHEMBL4936403 0.81 ESR2 (0.46) GPR119ESR2NR1H2USP30MEN1
SCHEMBL4937581 0.81 ESR2 (0.46) GPR119ESR2NR1H2USP30MEN1
SCHEMBL5446560 0.80 ESR2 (0.64) GPR119ESR2NR1H2NPC1RAB9A
SCHEMBL5446905 0.80 ESR2 (0.64) GPR119ESR2NR1H2NPC1RAB9A
SCHEMBL5446908 0.80 ESR2 (0.64) GPR119ESR2NR1H2NPC1RAB9A
SCHEMBL4933094 0.79 ESR2 (0.53) ESR2NR1H2MEN1KMT2A
SCHEMBL4929711 0.79 ESR2 (0.53) ESR2NR1H2MEN1KMT2A

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-2005042491-A1 BENZAZEPINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT2C RECEPTOR ASSOCIATED DISEASES ARENA PHARMACEUTICALS, INC. (US) 2005-05-12 WO disclosed