SCHEMBL9007559

SCHEMBL9007559

CCCCc1nc2c(n1Cc1ccc(-c3ccccc3C(=O)O)cc1)C(=O)C(C)=C(C(=O)O)C2=O

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.65
AGTR2 P50052 2/20 0.65
PPARG P37231 3/20 0.61

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
SCHEMBL9007499 0.96 AGTR1 (0.65) AGTR1AGTR2PPARG
SCHEMBL9007500 0.94 AGTR1 (0.68) AGTR1AGTR2PPARG
SCHEMBL9007510 0.92 AGTR1 (0.60) AGTR1AGTR2PPARG
SCHEMBL9007561 0.89 AGTR1 (0.60) AGTR1AGTR2PPARG
SCHEMBL9396659 0.89 AGTR1 (0.62) AGTR1AGTR2PPARG
SCHEMBL9007540 0.88 AGTR1 (0.61) AGTR1AGTR2PPARG
SCHEMBL9007461 0.88 AGTR1 (0.63) AGTR1AGTR2PPARG
SCHEMBL9007478 0.87 AGTR1 (0.67) AGTR1AGTR2PPARG
SCHEMBL9007505 0.87 AGTR1 (0.62) AGTR1AGTR2PPARG
SCHEMBL9007528 0.87 AGTR1 (0.62) 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-5506361-A ACTS BOTH AS AN ANGIOTENSIN II ANTAGONIST AND A LIPIDPEROXIDATION INHIBITOR THEUPJOHN COMPANY (US) 1996-04-09 US claimed
WO-1992019211-A2 IMIDAZOBENZOQUINONES AND COMPOSITION FOR PREVENTING OR TREATING HYPERTENSION OR CONGESTIVE HEART FAILURE CONTAINING THE SAME THE UPJOHN COMPANY (US) 1992-11-12 WO claimed
US-5506361-A ACTS BOTH AS AN ANGIOTENSIN II ANTAGONIST AND A LIPIDPEROXIDATION INHIBITOR THEUPJOHN COMPANY (US) 1996-04-09 US disclosed
EP-0586466-A1 IMIDAZOBENZOQUINONES AND COMPOSITION FOR PREVENTING OR TREATING HYPERTENSION OR CONGESTIVE HEART FAILURE CONTAINING THE SAME PHARMACIA & UPJOHN COMPANY (US) 1994-03-16 EP disclosed
WO-1992019211-A2 IMIDAZOBENZOQUINONES AND COMPOSITION FOR PREVENTING OR TREATING HYPERTENSION OR CONGESTIVE HEART FAILURE CONTAINING THE SAME THE UPJOHN COMPANY (US) 1992-11-12 WO disclosed