SCHEMBL9044849

SCHEMBL9044849

CCCCc1nc(CCNC(=O)OC(C)(C)C)c(Cc2ccc(-c3ccccc3C(=O)OC)cc2)[nH]1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 3/20 0.45
AGTR1 P30556 2/20 0.44
AGTR2 P50052 2/20 0.44
ACHE P22303 2/20 0.41
LTB4R2 Q9NPC1 1/20 0.40
BDKRB1 P46663 1/20 0.38

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
Hydrochloric Acid SCHEMBL8992385 0.84 AGTR1 (0.48) BRS3AGTR1AGTR2ACHELTB4R2
SCHEMBL9044276 0.81 AGT (0.43) AGTR1AGTR2
SCHEMBL9045987 0.79 ACHE (0.42) BRS3AGTR1AGTR2ACHE
SCHEMBL9302701 0.76 BRS3 (0.45) BRS3AGTR1AGTR2ACHELTB4R2
SCHEMBL9043004 0.76 BRS3 (0.42) BRS3AGTR1AGTR2ACHE
SCHEMBL9044845 0.76 AGTR1 (0.51) AGTR1AGTR2ACHE
SCHEMBL8979814 0.74 AGTR1 (0.48) BRS3AGTR1AGTR2ACHELTB4R2
SCHEMBL9054292 0.73 ACHE (0.44) BRS3AGTR1AGTR2ACHE
SCHEMBL9136676 0.73 AGTR1 (0.49) BRS3AGTR1AGTR2ACHELTB4R2
SCHEMBL9303312 0.72 BRS3 (0.38) BRS3AGTR1AGTR2ACHEBDKRB1

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