SCHEMBL9554376

SCHEMBL9554376

CCCc1c(C)n(CCC2CCCCC2)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.52
AGTR2 P50052 6/20 0.52

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
SCHEMBL9554821 0.96 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9554527 0.92 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9554095 0.92 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL9554922 0.92 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9734153 0.91 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL9533829 0.91 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL7686529 0.91 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL7683758 0.91 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9554171 0.90 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9532838 0.90 AGTR1 (0.51) 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-5238952-A Treating glaucoma disorders G. D. SEARLE & CO. (US) 1993-08-24 US disclosed