SCHEMBL7684770

SCHEMBL7684770

CCCc1c(C)n(CC2CCCCC2)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cn1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC33A1 O00400 2/20 0.36
AGTR1 P30556 2/20 0.36
AGTR2 P50052 2/20 0.36
PDE1A P54750 1/20 0.34
PDE1B Q01064 1/20 0.34
PDE1C Q14123 1/20 0.34
GNRHR P30968 2/20 0.34
PPARG P37231 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA2B P29275 1/20 0.32
ADORA1 P30542 1/20 0.32

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
SCHEMBL7682154 0.96 AGTR1 (0.39) SLC33A1AGTR1AGTR2PPARG
SCHEMBL7677759 0.95 AGTR1 (0.37) SLC33A1AGTR1AGTR2GNRHRPPARG
SCHEMBL7676947 0.92 AGTR1 (0.41) SLC33A1AGTR1AGTR2PPARG
SCHEMBL7681898 0.91 AGTR1 (0.37) SLC33A1AGTR1AGTR2PDE1APDE1B
SCHEMBL7677735 0.89 AGTR1 (0.44) AGTR1AGTR2PPARG
SCHEMBL9554922 0.89 AGTR1 (0.46) SLC33A1AGTR1AGTR2PPARG
SCHEMBL7686050 0.88 SLC33A1 (0.35) SLC33A1AGTR1AGTR2
SCHEMBL7685919 0.88 SLC33A1 (0.38) SLC33A1AGTR1AGTR2
SCHEMBL7678860 0.88 AGTR1 (0.42) AGTR1AGTR2PPARG
SCHEMBL7681024 0.88 AGTR1 (0.40) AGTR1AGTR2PPARG

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-6492397-B1 SUCH AS 1-PROPYL-4-BUTYL-1,3-DIHYDRO-3-((5-(2-(1H-TETRAZOL-5-YL)PHENYL)-2 -PYRIDINYL)METHYL)-2H-IMIDAZOL-2-ONE; ANGIO-TENSIN II ANTAGONISTS; CIRCULATORY DISORDERS; HYPERTENSION, CONGESTIVE HEART FAILURE PHARMACIA CORPORATION 2002-12-10 US disclosed
EP-0579766-A1 N-ARYLHETEROARYLALKYL IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1994-01-26 EP disclosed
US-5164403-A Hypotensive agents, cardiovascular disorders G. D. SEARLE & CO. (US) 1992-11-17 US disclosed
WO-1992017469-A2 N-ARYLHETEROARYLALKYL IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-10-15 WO disclosed
EP-0508393-A1 N-arylheteroarylalkyl imidazol-2-one compounds for treatment of circulatory disorders G.D. Searle & Co. (US) 1992-10-14 EP disclosed