SCHEMBL8944383

SCHEMBL8944383

CCCCc1nc2c(C)ccc(OCc3ccccc3)c2n1Cc1ccc(-c2ccccc2C(=O)OC(=O)C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.47

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
SCHEMBL8944564 0.93 PPARG (0.47) PPARG
Trifluoroacetic Acid SCHEMBL8944378 0.90 PPARG (0.55) PPARG
SCHEMBL8391844 0.89 PPARG (0.49) PPARG
SCHEMBL8395276 0.89 PPARG (0.59) PPARG
SCHEMBL8944796 0.88 PPARG (0.49) PPARG
SCHEMBL8847656 0.86 AGTR1 (0.47) PPARG
Trifluoroacetic Acid SCHEMBL9042949 0.85 AGTR1 (0.43) PPARG
SCHEMBL8944794 0.85 PPARG (0.57) PPARG
SCHEMBL8396044 0.85 AGTR1 (0.43)
Trifluoroacetic Acid SCHEMBL8391817 0.84 PPARG (0.56) PPARG

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
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed