SCHEMBL9313461

SCHEMBL9313461

CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 0.85

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.70
AGTR1 P30556 5/20 0.67
AGTR2 P50052 4/20 0.66

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
SCHEMBL8561056 0.93 AGTR1 (0.63) PPARGAGTR1AGTR2
SCHEMBL683347 0.92 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL8873549 0.90 AGTR1 (0.62) PPARGAGTR1AGTR2
SCHEMBL8972114 0.86 PPARG (0.73) PPARGAGTR1AGTR2
SCHEMBL8972103 0.85 AGTR1 (0.53) PPARGAGTR1AGTR2
SCHEMBL8559031 0.85 AGTR1 (0.65) AGTR1AGTR2
SCHEMBL683364 0.85 AGTR1 (0.59) PPARGAGTR1AGTR2
SCHEMBL8873855 0.84 AGTR1 (0.63) AGTR1AGTR2
SCHEMBL8566014 0.84 AGTR1 (0.54) PPARGAGTR1AGTR2
SCHEMBL8561087 0.84 AGTR1 (0.64) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0598702-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-05-25 EP claimed
EP-0420237-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1991-04-03 EP claimed
EP-0628557-A1 Biphenylmethane derivatives, the use of them and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-12-14 EP disclosed
US-5328911-A Cardiovascular disorders, hypotensive agents and congestive heart failure EISAI CO., LTD. (JP) 1994-07-12 US disclosed
EP-0598702-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-05-25 EP disclosed
US-5298518-A Biphenylmethane derivative and pharmacological use EISAI CO., LTD. (JP) 1994-03-29 US disclosed
EP-0420237-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1991-04-03 EP disclosed