SCHEMBL8417384

SCHEMBL8417384

CCCCOc1nc2c(C)ccc(C(=O)OC)c2n1-c1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.36

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
SCHEMBL8417421 0.93 AGTR1 (0.34)
SCHEMBL8417914 0.89 PDCD1 (0.36)
SCHEMBL8419603 0.89 AGTR1 (0.34)
SCHEMBL8419023 0.89 ALDH1A1 (0.36)
SCHEMBL8631046 0.89 PLA2G2A (0.33) PLA2G2A
SCHEMBL8421091 0.88 BDKRB1 (0.34)
SCHEMBL8418010 0.88 POLB (0.33)
SCHEMBL8417423 0.87 RIPK1 (0.36)
SCHEMBL8417952 0.85 AGTR1 (0.34)
SCHEMBL8419127 0.85 AGTR1 (0.34)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962491-A ANGIOTENSIN ANTAGONIST, HYPOTENSIVE AGENTS, CARDIOVASCULAR DISORDERS, STROKES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-05 US disclosed
US-5763619-A HYPOTENSIVE AGENTS, CARDIOVASCULAR DISORDERS OR STROKES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-09 US disclosed
US-5703110-A HYPOTENSIVE AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-30 US disclosed