SCHEMBL9592129

SCHEMBL9592129

CCCN(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)c1nc(OCc2ccccc2)ccc1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 19/20 0.61
AGTR2 P50052 19/20 0.61

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
SCHEMBL9590340 0.93 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL9590387 0.93 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9592237 0.92 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9589218 0.92 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9590294 0.91 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9682141 0.87 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL9589040 0.86 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL9591631 0.86 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9681097 0.85 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9592211 0.84 AGTR1 (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5250548-A Treating hypertension, heart failure ABBOTT LABORATORIES (US) 1993-10-05 US disclosed