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SCHEMBL8976534

SCHEMBL8976534

CCCCc1nc(Cl)c(CO)n1Cc1ccc([C@H]2CCCC[C@@H]2c2nnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 2/20 0.50
▸ AGTR2 P50052 2/20 0.50

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
SCHEMBL8976549 1.00 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL8976538 1.00 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL8976717 0.87 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8976726 0.87 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8976721 0.87 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9284564 0.81 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL3407499 0.79 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL4960875 0.78 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL8976799 0.77 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL8976795 0.77 AGTR1 (0.59) 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-5508299-A ANGIOTENSIN CONVERTING ENZYME INHIBITOR, ARTERIAL HYPOTENSIVE AGENT; CARDIOVASCULAR DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 1996-04-16 — — US disclosed