SCHEMBL6545686

SCHEMBL6545686

CCC=Cc1nc(Cl)c(CO)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.44
AGTR2 P50052 3/20 0.44
ABCC4 O15439 1/20 0.44
ABCB11 O95342 1/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 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
SCHEMBL683439 1.00 AGTR1 (0.44) AGTR1AGTR2ABCC4ABCB11PDE3B
SCHEMBL11 0.86 GP6 (0.49) AGTR1AGTR2
SCHEMBL13 0.86 GP6 (0.49) AGTR1AGTR2
SCHEMBL962 0.82 AGTR1 (0.59) AGTR1AGTR2ABCC4ABCB11PDE3B
SCHEMBL6545679 0.81 AGTR1 (0.48) AGTR1AGTR2ABCC4ABCB11PDE3B
Losartan SCHEMBL29383742 0.80 AGTR1 (0.67) AGTR1AGTR2ABCC4ABCB11PDE3B
Losartan SCHEMBL6092394 0.80 AGTR1 (0.67) AGTR1AGTR2ABCC4ABCB11PDE3B
Losartan SCHEMBL60 0.80 AGTR1 (0.67) AGTR1AGTR2ABCC4ABCB11PDE3B
SCHEMBL9853642 0.80 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9853644 0.80 AGTR1 (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1019048-B1 USE OF AN ANGIOTENSIN II RECEPTOR ANTAGONIST FOR THE PREPARATION OF DRUGS TO INCREASE THE SURVIVAL RATE OF RENAL TRANSPLANT PATIENTS MERCK SHARP DOHME ITALIA S P A (IT) 2004-01-21 EP claimed
EP-0733366-B1 Pharmaceutical compositions comprising angiotensin II receptor blocking imidazoles and diuretics DU PONT (US) 1998-04-01 EP claimed