SCHEMBL5845867

SCHEMBL5845867

[O]Cc1nnc(C2CCN(c3ccccn3)CC2)n1Cc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 20/20 0.76

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
SCHEMBL5212432 0.88 AVPR1A (0.76) AVPR1A
SCHEMBL5215427 0.86 AVPR1A (1.00) AVPR1A
SCHEMBL5212353 0.86 AVPR1A (0.82) AVPR1A
SCHEMBL5211608 0.85 AVPR1A (0.84) AVPR1A
SCHEMBL5216132 0.85 AVPR1A (0.72) AVPR1A
SCHEMBL5214851 0.85 AVPR1A (0.81) AVPR1A
SCHEMBL5214915 0.84 AVPR1A (1.00) AVPR1A
SCHEMBL5218432 0.84 AVPR1A (1.00) AVPR1A
SCHEMBL5211898 0.84 AVPR1A (0.73) AVPR1A
SCHEMBL5215730 0.84 AVPR1A (0.78) AVPR1A

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
US-7084145-B2 Triazole compounds useful in therapy PFIZER INC. (US) 2006-08-01 US claimed