SCHEMBL8559430

SCHEMBL8559430

CCCOc1nc2c(C)ccnc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.68
AGTR2 P50052 1/20 0.68
PPARG P37231 3/20 0.56
MME P08473 2/20 0.51

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
SCHEMBL8564718 0.92 AGTR1 (0.70) AGTR1AGTR2PPARGMME
SCHEMBL9847799 0.91 AGTR1 (0.56) AGTR1AGTR2PPARGMME
SCHEMBL8568074 0.89 AGTR1 (0.72) AGTR1AGTR2PPARG
SCHEMBL8972103 0.88 AGTR1 (0.53) AGTR1AGTR2PPARG
SCHEMBL8971658 0.86 AGTR1 (0.75) AGTR1AGTR2PPARG
SCHEMBL8972114 0.86 PPARG (0.73) AGTR1AGTR2PPARG
SCHEMBL8972109 0.85 AGTR1 (0.72) AGTR1AGTR2PPARG
SCHEMBL8972327 0.84 AGTR1 (0.73) AGTR1AGTR2PPARG
SCHEMBL7851749 0.84 AGTR1 (0.67) AGTR1AGTR2PPARG
SCHEMBL8559181 0.83 AGTR1 (0.68) AGTR1AGTR2PPARG

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0598702-B1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same EISAI CO LTD (JP) 1998-06-10 EP claimed
EP-0598702-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-05-25 EP claimed
EP-0598702-B1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same EISAI CO LTD (JP) 1998-06-10 EP disclosed
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