SCHEMBL9055422

SCHEMBL9055422

CCCN1NC(Cc2ccccc2)=C(C(=O)OCC)C1Cc1ccc(-c2ccccc2-c2nnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.39

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
SCHEMBL9041118 1.00 AGTR1 (0.39) AGTR1
SCHEMBL9057090 0.90 AGTR1 (0.41) AGTR1
SCHEMBL9056133 0.89 AGTR1 (0.43) AGTR1
SCHEMBL9039995 0.89 AGTR1 (0.39) AGTR1
SCHEMBL9043557 0.88 AGTR1 (0.39) AGTR1
SCHEMBL9042789 0.88 AGTR1 (0.40) AGTR1
SCHEMBL9042536 0.87 AGTR1 (0.39) AGTR1
SCHEMBL9041610 0.87 AGTR1 (0.40) AGTR1
SCHEMBL9043115 0.85 AGTR1 (0.41) AGTR1
SCHEMBL9040768 0.85 AGTR1 (0.42) AGTR1

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-0721454-A1 NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST J. URIACH & CIA. S.A. (ES) 1996-07-17 EP disclosed
WO-1996004273-A1 NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST J. URIACH & CIA, S.A. (ES) 1996-02-15 WO disclosed