SCHEMBL9844182

SCHEMBL9844182

CCCCc1nc(C)cc(=O)n1Cc1ccc(-c2ccccc2C(=O)OC)cc1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.56
AGTR2 P50052 2/20 0.56

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
SCHEMBL9844226 0.90 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9843834 0.89 AGTR1 (0.69) AGTR1AGTR2
SCHEMBL8873855 0.85 AGTR1 (0.63) AGTR1AGTR2
SCHEMBL9427397 0.84 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9850563 0.83 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9195616 0.83 AGTR1 (0.80) AGTR1AGTR2
SCHEMBL1076 0.83 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL462 0.82 AGTR2 (0.80) AGTR1AGTR2
SCHEMBL1417594 0.82 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL8089342 0.81 AGTR1 (0.56) 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-0407342-A2 Pyrimidine derivatives CIBA-GEIGY AG (CH) 1991-01-09 EP disclosed