SCHEMBL7354594

SCHEMBL7354594

Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC/C(=N\O)c3ccccc32)cc1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 12/20 0.67
AVPR2 P30518 9/20 0.67
OXTR P30559 1/20 0.67
AVPR1B P47901 1/20 0.61

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
SCHEMBL7354596 1.00 AVPR1A (0.67) AVPR1AAVPR2OXTRAVPR1B
SCHEMBL7347424 0.88 AVPR1A (0.61) AVPR1AAVPR2OXTRAVPR1B
SCHEMBL7347427 0.88 AVPR1A (0.61) AVPR1AAVPR2OXTRAVPR1B
SCHEMBL6991132 0.88 AVPR1A (0.72) AVPR1AAVPR2OXTRAVPR1B
SCHEMBL7349014 0.86 AVPR1A (0.70) AVPR1AAVPR2OXTRAVPR1B
SCHEMBL7351740 0.83 AVPR2 (0.94) AVPR1AAVPR2OXTR
SCHEMBL7343204 0.82 RAB9A (0.49) AVPR1A
SCHEMBL7343206 0.82 RAB9A (0.49) AVPR1A
SCHEMBL6967016 0.82 AVPR1A (0.64) AVPR1AAVPR2OXTR
SCHEMBL9577582 0.82 AVPR1A (0.64) AVPR1AAVPR2OXTRAVPR1B

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-1994001113-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-01-20 WO disclosed