SCHEMBL8524093

SCHEMBL8524093

CCCCCN(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)[C@H](C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 18/20 0.50
LTB4R2 Q9NPC1 3/20 0.45
ABCB11 O95342 1/20 0.45
GP6 Q9HCN6 1/20 0.45
AGTR2 P50052 10/20 0.43

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
SCHEMBL8477688 1.00 AGTR1 (0.50) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2773 0.91 AGTR1 (0.51) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL8477037 0.91 AGTR1 (0.51) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL8472989 0.90 AGTR1 (0.47) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2477 0.89 AGTR1 (0.46) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL9490569 0.88 AGTR1 (0.47) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2965 0.85 AGTR1 (0.67) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2966 0.85 AGTR1 (0.67) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2529 0.84 AGTR1 (0.53) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2692 0.84 AGTR1 (0.44) AGTR1LTB4R2ABCB11GP6AGTR2

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-5965592-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1999-10-12 US disclosed