SCHEMBL8488204

SCHEMBL8488204

CCOC(=O)N(Cc1ccc2nc(-c3ccccc3-c3nnn[nH]3)ccc2c1)[C@H](C(=O)O)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
AGTR1 P30556 10/20 0.39
ABCB11 O95342 1/20 0.39
GP6 Q9HCN6 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39

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
SCHEMBL8486014 0.94 AGTR1 (0.38) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL8481890 0.92 ALDH1A1 (0.39) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL8484261 0.91 AGTR1 (0.42) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL8488010 0.91 AGTR1 (0.36) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL8487025 0.90 AGTR1 (0.47) ALDH1A1LMNAAGTR1ABCB11GP6
SCHEMBL8806563 0.88 AGTR1 (0.53) AGTR1ABCB11GP6LTB4R2
SCHEMBL8482053 0.88 ALDH1A1 (0.46) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL8807131 0.88 AGTR1 (0.50) AGTR1ABCB11GP6LTB4R2
SCHEMBL8808964 0.86 AGTR1 (0.38) AGTR1ABCB11GP6LTB4R2
SCHEMBL8485885 0.86 AGTR1 (0.36) ALDH1A1LMNAPOLBHSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5955487-A TREATING HIGH BLOOD PRESSURE, CARDIAC INSUFFICIENCY, GLAUCOMA CIBA-GEIGY CORPORATION (US) 1999-09-21 US disclosed
EP-0528762-B1 N-acyl-N-heterocyclyl- or naphthyl-alkyl amino acids as angiotensin II antagonists CIBA GEIGY AG (CH) 1997-05-07 EP 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
EP-0528762-A1 N-acyl-N-heterocyclyl- or naphthyl-alkyl amino acids as angiotensin II antagonists CIBA-GEIGY AG (CH) 1993-02-24 EP disclosed