SCHEMBL7309330

SCHEMBL7309330

CCCc1nc2c(n1Cc1ccc(-c3ccccc3-c3nnn[nH]3)cc1)C(=O)CCCC2O

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 16/20 0.55
AGTR2 P50052 15/20 0.55

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
Pratosartan SCHEMBL93595 0.86 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL683741 0.85 AGTR1 (0.72) AGTR1AGTR2
SCHEMBL683401 0.81 AGTR1 (0.74) AGTR1AGTR2
SCHEMBL93596 0.81 AGTR2 (0.71) AGTR1AGTR2
SCHEMBL683452 0.80 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL7416052 0.77 AGTR1 (0.63) AGTR1AGTR2
SCHEMBL9007544 0.76 AGTR2 (0.49) AGTR1AGTR2
SCHEMBL9076746 0.76 AGTR1 (0.68) AGTR1AGTR2
SCHEMBL9402072 0.76 PDE4A (0.55) AGTR1AGTR2
SCHEMBL9194632 0.76 PPARG (0.62) 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
JP-2000128877-A CYCLOHEPTIMIDAZOLE DERIVATIVE AND ITS PRODUCTION KOTOBUKI SEIYAKU KK 2000-05-09 JP disclosed