SCHEMBL9044951

SCHEMBL9044951

CCCCc1nc2c(n1Cc1ccc(-c3ccccc3-c3nnn[nH]3)cc1)C(C(=O)O)N(C(=O)CC(=O)OCC)CC2

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.45
AGTR2 P50052 4/20 0.45
PPARG P37231 6/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL9044302 0.94 AGTR1 (0.44) AGTR1AGTR2PPARGKCNH2
SCHEMBL9142252 0.91 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9046254 0.90 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9144625 0.89 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9141881 0.88 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9045425 0.88 AGTR1 (0.39) AGTR1AGTR2PPARGKCNH2
SCHEMBL9558461 0.87 AGTR1 (0.47) AGTR1AGTR2PPARG
SCHEMBL9043684 0.86 AGTR1 (0.43) AGTR1AGTR2PPARG
SCHEMBL9042989 0.86 AGT (0.52) AGTR1AGTR2PPARGKCNH2
SCHEMBL9141171 0.85 AGTR1 (0.43) AGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0531876-B1 Imidazoindolizine derivatives and process for preparation thereof TANABE SEIYAKU CO (JP) 1996-12-18 EP disclosed
US-5424316-A Imidazopyridine derivatives for the treatment of hypertension TANABE SEIYAKU CO., LTD. (JP) 1995-06-13 US disclosed
US-5409936-A Useful in prophylaxix; exhibits potent angiotensin ii inhibitory acivities TANABE SEIYAKU CO., LTD. (JP) 1995-04-25 US disclosed
US-5268377-A Imidazoindolizine derivatives process for preparation thereof and use thereof to treat hypertension TANABE SEIYAKU CO., LTD. (JP) 1993-12-07 US disclosed
EP-0531876-A2 Imidazoindolizine derivatives and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1993-03-17 EP disclosed
EP-0531874-A1 Imidazopyridine derivatives and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1993-03-17 EP disclosed