SCHEMBL3841408

SCHEMBL3841408

CCCC(C)(Oc1ccc(CCCCOc2nn(CCCC(F)(F)F)c(=O)n(C)c2=O)cc1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.41
PPARG P37231 13/20 0.41
PPARD Q03181 11/20 0.41

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
SCHEMBL3842418 0.97 PPARA (0.39) PPARAPPARGPPARD
SCHEMBL3842859 0.91 PPARA (0.42) PPARAPPARGPPARD
SCHEMBL3845479 0.91 PPARA (0.51) PPARAPPARGPPARD
SCHEMBL3842005 0.90 PPARG (0.42) PPARAPPARGPPARD
SCHEMBL3845631 0.90 PPARA (0.44) PPARAPPARGPPARD
SCHEMBL3841403 0.90 PPARA (0.43) PPARAPPARGPPARD
SCHEMBL3849389 0.89 PPARA (0.41) PPARAPPARGPPARD
SCHEMBL3847191 0.88 PPARG (0.42) PPARAPPARGPPARD
SCHEMBL3842663 0.87 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL3842837 0.86 PPARA (0.49) PPARAPPARGPPARD

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-1856065-B1 1,2,4-TRIAZINE DERIVATIVES, PREPARATION AND USE THEREOF IN HUMAN THERAPY PF MEDICAMENT (FR) 2009-11-11 EP claimed