SCHEMBL9847835

SCHEMBL9847835

COc1nc2c(C)cc(C)nc2n1Cc1ccc(-c2ccccc2)c(-c2nnn[nH]2)c1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.47
AGTR2 P50052 4/20 0.47
GPR4 P46093 2/20 0.41
PPARG P37231 1/20 0.40

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
SCHEMBL8566867 0.92 AGTR2 (0.54) AGTR1AGTR2
SCHEMBL9847882 0.91 AGTR1 (0.48) AGTR1AGTR2GPR4PPARG
SCHEMBL9847847 0.90 AGTR1 (0.47) AGTR1AGTR2GPR4PPARG
SCHEMBL9847838 0.89 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL8741166 0.86 AGTR2 (0.61) AGTR1AGTR2GPR4PPARG
SCHEMBL9847826 0.85 AGTR1 (0.62) AGTR1AGTR2GPR4
SCHEMBL9847830 0.84 AGTR1 (0.53) AGTR1AGTR2GPR4PPARG
SCHEMBL683358 0.83 AGTR2 (0.54) AGTR1AGTR2
SCHEMBL9089289 0.82 AGTR1 (0.42) AGTR1AGTR2GPR4
SCHEMBL8563844 0.81 AGTR2 (0.53) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420237-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1991-04-03 EP claimed
EP-0420237-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1991-04-03 EP disclosed