SCHEMBL6857014

SCHEMBL6857014

Cc1c(CC(=O)NC(C)C)c(-c2cccc(Cl)c2)nc2ccc(OCCCN3CCCCC3)cc12

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 20/20 0.72

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
SCHEMBL6856705 0.90 AVPR1B (0.58) AVPR1B
SCHEMBL6856889 0.86 AVPR1B (0.56) AVPR1B
SCHEMBL6857205 0.86 AVPR1B (0.65) AVPR1B
SCHEMBL3116140 0.84 AVPR1B (1.00) AVPR1B
SCHEMBL6857472 0.83 AVPR1B (0.51) AVPR1B
Hydrochloric Acid SCHEMBL3124659 0.83 AVPR1B (0.98) AVPR1B
SCHEMBL6855740 0.83 AVPR1B (0.51) AVPR1B
SCHEMBL6857266 0.81 AVPR1B (0.49) AVPR1B
SCHEMBL6857265 0.81 AVPR1B (0.48) AVPR1B
SCHEMBL6856869 0.80 AVPR1B (0.45) AVPR1B

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