SCHEMBL9437299

SCHEMBL9437299

CCCCc1nc2c(c(=O)n1Cc1ccc(-c3ccccc3-c3nnn[nH]3)cc1)CN(C(C)=O)CC2

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.48
AGTR2 P50052 4/20 0.48

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
SCHEMBL9437285 0.89 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL9308826 0.89 LMNA (0.48) AGTR1AGTR2
SCHEMBL9844152 0.87 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9844103 0.86 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL7821436 0.81 AGTR1 (0.57) AGTR1
SCHEMBL9144625 0.81 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL7812897 0.81 AGTR1 (0.53) AGTR1
SCHEMBL9141881 0.81 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9141887 0.81 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL9584455 0.80 AGTR1 (0.45) AGTR1AGTR2

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-5281602-A Pharmaceuticals AMERICAN CYANAMID COMPANY (US) 1994-01-25 US claimed