SCHEMBL9044276

SCHEMBL9044276

CCCCc1nc(CCNC(=O)OC(C)(C)C)c(Cc2ccc(-c3ccccc3-c3nnnn3C(c3ccccc3)(c3ccccc3)c3ccccc3)cc2)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGT P01019 2/20 0.43
AGTR1 P30556 3/20 0.43
AGTR2 P50052 3/20 0.43
AKT1 P31749 1/20 0.38
TLR7 Q9NYK1 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
SCHEMBL9142863 0.84 AGTR1 (0.46) AGTAGTR1AGTR2
SCHEMBL9247811 0.82 AGTR1 (0.47) AGTAGTR1AGTR2
SCHEMBL9044849 0.81 BRS3 (0.45) AGTR1AGTR2
SCHEMBL9044274 0.80 AGT (0.51) AGTAGTR1AGTR2TLR7
SCHEMBL9042308 0.79 AGTR1 (0.49) AGTAGTR1AGTR2
SCHEMBL9053263 0.77 AGTR1 (0.49) AGTAGTR1AGTR2
SCHEMBL839523 0.77 CD274 (0.51) AGTAGTR1AGTR2AKT1
SCHEMBL9140681 0.77 AGTR1 (0.46) AGTAGTR1AGTR2
SCHEMBL4566052 0.76 AGTR1 (0.40) AGTAGTR1AGTR2AKT1
SCHEMBL7312346 0.76 AGT (0.46) AGTAGTR1AGTR2

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
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
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