SCHEMBL6857461

SCHEMBL6857461

Cc1c(CC(=O)NC(C)C)c(-c2ccc(F)c(Cl)c2)nc2ccc(N3CCCC(CN4CCOCC4)C3)cc12

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 13/20 0.44
AVPR1A P37288 4/20 0.43
PRKDC P78527 1/20 0.40
ACACB O00763 1/20 0.38

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
SCHEMBL6856192 0.83 AVPR1B (0.46) AVPR1BAVPR1A
SCHEMBL6854936 0.81 AVPR1B (0.41) AVPR1BACACB
SCHEMBL6857500 0.81 AVPR1B (0.41) AVPR1BACACB
SCHEMBL6856891 0.81 AVPR1B (0.40) AVPR1BACACB
SCHEMBL6856813 0.80 AVPR1B (0.40) AVPR1BACACB
SCHEMBL6855979 0.75 AVPR1B (0.39) AVPR1B
SCHEMBL6857472 0.75 AVPR1B (0.51) AVPR1B
SCHEMBL6856235 0.74 AVPR1B (0.39) AVPR1B
SCHEMBL6857266 0.74 AVPR1B (0.49) AVPR1BAVPR1A
SCHEMBL6856801 0.73 HRH3 (0.43) AVPR1BACACB

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-2011096461-A1 QUINOLINE DERIVATIVE 大正製薬株式会社 (JP) 2011-08-11 WO disclosed