Sugi Predict

Sugi Predict / Compounds / SCHEMBL7308925

SCHEMBL7308925

SCHEMBL7308925

CCCCc1nc(C(C)O)c(C(=O)OCc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 6/20 0.39
▸ AGTR2 P50052 6/20 0.39
▸ BRS3 P32247 3/20 0.37
▸ PPARG P37231 7/20 0.37
▸ KCNH2 Q12809 1/20 0.37

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
SCHEMBL3841057 0.95 AGTR1 (0.41) AGTR1AGTR2PPARGKCNH2
SCHEMBL7308392 0.87 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL3844399 0.85 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL3841156 0.82 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL7310274 0.81 AGT (0.45) AGTR1AGTR2BRS3PPARGKCNH2
SCHEMBL7307408 0.81 PPARG (0.36) AGTR1AGTR2BRS3PPARGKCNH2
SCHEMBL1673090 0.80 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL7305287 0.79 BRS3 (0.36) AGTR1AGTR2BRS3PPARG
SCHEMBL7307299 0.78 AGTR1 (0.49) AGTR1AGTR2PPARGKCNH2
SCHEMBL6534713 0.76 BRS3 (0.39) AGTR1AGTR2BRS3PPARG

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-0545912-B1 1-Biphenylmethylimidazole derivatives, their preparation and their therapeutic use SANKYO CO (JP) 2001-04-25 — — EP claimed
EP-0503785-A1 1-Biphenylimidazole derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1992-09-16 — — EP disclosed