SCHEMBL27

SCHEMBL27

CCCCc1nc(Cl)c(Cc2nnn[nH]2)n1Cc1cccc(-c2nnn[nH]2)c1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABCC4 O15439 1/20 0.42
ABCB11 O95342 1/20 0.42
AGTR1 P30556 1/20 0.42
AGTR2 P50052 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42

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
SCHEMBL162 0.90 AGTR1 (0.47) ABCC4ABCB11AGTR1AGTR2PDE3B
SCHEMBL10533882 0.89 ABCC4 (0.37) ABCC4ABCB11AGTR1AGTR2PDE3B
SCHEMBL14286268 0.81 AGTR1 (0.58) ABCC4ABCB11AGTR1AGTR2PDE3B
SCHEMBL1457700 0.77 AGTR1 (0.59) ABCC4ABCB11AGTR1AGTR2PDE3B
SCHEMBL8071013 0.76 AGTR1 (0.58) ABCC4ABCB11AGTR1AGTR2PDE3B
Potassium SCHEMBL8071014 0.76 AGTR1 (0.58) ABCC4ABCB11AGTR1AGTR2PDE3B
SCHEMBL907 0.76 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL13755335 0.75 AGTR1 (0.58) ABCC4ABCB11AGTR1AGTR2PDE3B
Losartan SCHEMBL29383742 0.74 AGTR1 (0.67) ABCC4ABCB11AGTR1AGTR2PDE3B
Losartan SCHEMBL60 0.74 AGTR1 (0.67) ABCC4ABCB11AGTR1AGTR2PDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733366-B1 Pharmaceutical compositions comprising angiotensin II receptor blocking imidazoles and diuretics DU PONT (US) 1998-04-01 EP disclosed
EP-0324377-B1 Angiotensin II receptor blocking imidazoles and combinations thereof with diuretics and NSaids DU PONT (US) 1997-04-16 EP disclosed
EP-0733366-A2 Pharmaceutical compositions comprising angiotensin II receptor blocking imidazoles and diuretics E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-09-25 EP disclosed
EP-0253310-B1 Angiotensin II receptor blocking imidazoles DU PONT (US) 1994-10-26 EP disclosed
US-5155118-A Administering angiotensin inhibitor E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-13 US disclosed
US-5153197-A Treatment of hypertension with angiotensin II blocking imidazoles E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-06 US disclosed
US-5138069-A Treating hypertension and congestive heart failure E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-11 US disclosed
US-5128355-A Hypotensive E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-07-07 US disclosed
EP-0324377-A2 Angiotensin II receptor blocking imidazoles and combinations thereof with diuretics and NSaids E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-07-19 EP disclosed
EP-0253310-A2 Angiotensin II receptor blocking imidazoles E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-01-20 EP disclosed