SCHEMBL8482137

SCHEMBL8482137

CCCCC(=O)N(Cc1ccc2cc(-c3ccccc3-c3nnn[nH]3)ccc2c1)CC1(C(=O)O)CCCC1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 10/20 0.43
LTB4R2 Q9NPC1 7/20 0.40
PTGDR2 Q9Y5Y4 3/20 0.39
ABCB11 O95342 1/20 0.36
GP6 Q9HCN6 1/20 0.36
PKM P14618 1/20 0.36
AGTR2 P50052 1/20 0.35

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
SCHEMBL8483446 0.99 AGTR1 (0.43) AGTR1LTB4R2PTGDR2ABCB11GP6
SCHEMBL8912327 0.98 AGTR1 (0.41) AGTR1LTB4R2PTGDR2ABCB11GP6
SCHEMBL8488367 0.95 AGTR1 (0.37) AGTR1LTB4R2PTGDR2ABCB11GP6
SCHEMBL8486732 0.92 AGTR1 (0.41) AGTR1LTB4R2PTGDR2ABCB11GP6
SCHEMBL8912222 0.92 OPRM1 (0.35) AGTR1LTB4R2PTGDR2AGTR2
Abitesartan SCHEMBL2527 0.92 AGTR1 (0.51) AGTR1LTB4R2ABCB11GP6
SCHEMBL3104 0.91 AGTR1 (0.50) AGTR1LTB4R2ABCB11GP6
SCHEMBL8483534 0.89 LTB4R2 (0.37) AGTR1LTB4R2PTGDR2PKMAGTR2
SCHEMBL8482593 0.89 AGTR1 (0.43) AGTR1LTB4R2PTGDR2ABCB11GP6
SCHEMBL8809889 0.89 AGTR1 (0.42) AGTR1LTB4R2PTGDR2ABCB11GP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528762-B1 N-acyl-N-heterocyclyl- or naphthyl-alkyl amino acids as angiotensin II antagonists CIBA GEIGY AG (CH) 1997-05-07 EP claimed
US-5955487-A TREATING HIGH BLOOD PRESSURE, CARDIAC INSUFFICIENCY, GLAUCOMA CIBA-GEIGY CORPORATION (US) 1999-09-21 US disclosed
US-5620998-A CARDIOVASCULAR DISORDERS; HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-04-15 US disclosed
US-5506240-A HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1996-04-09 US disclosed