SCHEMBL9685271

SCHEMBL9685271

CCCCc1nc(Cl)c(C=O)n1Cc1ccc(C2(C#N)CCCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.49
AGTR2 P50052 5/20 0.49
GP6 Q9HCN6 1/20 0.49

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
SCHEMBL9683853 0.83 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL9685772 0.83 AGTR1 (0.56) AGTR1AGTR2GP6
SCHEMBL9685819 0.82 AGTR1 (0.57) AGTR1AGTR2GP6
SCHEMBL9685773 0.80 AGTR1 (0.55) AGTR1AGTR2GP6
SCHEMBL9422648 0.79 AGTR1 (0.52) AGTR1AGTR2GP6
SCHEMBL18003201 0.79 AGTR1 (0.61) AGTR1AGTR2GP6
SCHEMBL9685865 0.79 AGTR1 (0.51) AGTR1AGTR2GP6
SCHEMBL8638896 0.78 AGTR1 (0.58) AGTR1AGTR2GP6
SCHEMBL8568897 0.77 AGTR1 (0.59) AGTR1AGTR2GP6
SCHEMBL4639444 0.77 AGTR1 (0.59) AGTR1AGTR2GP6

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
EP-0485929-A1 Substituted azoles, process for their preparation and their application HOECHST AKTIENGESELLSCHAFT (DE) 1992-05-20 EP disclosed