SCHEMBL9274182

SCHEMBL9274182

CCCCc1nc(-c2ccccc2C(=O)OC)cn1Cc1ccc(-c2ccccc2)c(C(=O)OC)c1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.55
AGTR2 P50052 2/20 0.55
TLR8 Q9NR97 1/20 0.52

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
SCHEMBL9024785 0.91 AGTR1 (0.65) AGTR1AGTR2TLR8
SCHEMBL9025617 0.83 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL9024072 0.82 AGTR1 (0.70) AGTR1AGTR2
SCHEMBL9025200 0.80 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9271984 0.80 AGTR1 (0.52) AGTR1AGTR2
Hydrochloric Acid SCHEMBL8992382 0.79 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9273712 0.79 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9844226 0.78 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8088458 0.77 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8792974 0.77 AGTR2 (0.70) 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
EP-0654030-A1 IMIDAZOLE DERIVATIVES HAVING A II ANTAGONIST ACTIVITY. LUSO FARMACO INST (IT) 1995-05-24 EP disclosed