SCHEMBL8971607

SCHEMBL8971607

Cc1ccnc2c1nc(OC(C)C)n2Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 7/20 0.50
AGTR1 P30556 6/20 0.50

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
SCHEMBL8561748 0.90 AGTR1 (0.52) AGTR2AGTR1
SCHEMBL8566359 0.89 AGTR1 (0.54) AGTR2AGTR1
SCHEMBL8971897 0.88 AGTR1 (0.54) AGTR2AGTR1
SCHEMBL8971480 0.87 AGTR1 (0.53) AGTR2AGTR1
Ammonia Solution, Strong SCHEMBL8971516 0.86 AGTR1 (0.51) AGTR2AGTR1
Ammonia Solution, Strong SCHEMBL9847776 0.86 AGTR1 (0.54) AGTR2AGTR1
SCHEMBL8972783 0.85 AGTR1 (0.48) AGTR2AGTR1
Ammonia Solution, Strong SCHEMBL8971614 0.85 AGTR2 (0.56) AGTR2AGTR1
SCHEMBL8972186 0.84 AGTR2 (0.59) AGTR2AGTR1
SCHEMBL8972949 0.84 AGTR2 (0.59) AGTR2AGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506238-A HYPOTENSIVE AGENT EISAI CO., LTD. (JP) 1996-04-09 US disclosed
EP-0628557-A1 Biphenylmethane derivatives, the use of them and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-12-14 EP disclosed
US-5328911-A Cardiovascular disorders, hypotensive agents and congestive heart failure EISAI CO., LTD. (JP) 1994-07-12 US disclosed
US-5298518-A Biphenylmethane derivative and pharmacological use EISAI CO., LTD. (JP) 1994-03-29 US disclosed