SCHEMBL3842930

SCHEMBL3842930

CCCCCCCn1c(=O)c(OCCCCCc2cccc(OC(C)(CCC)C(=O)O)c2)nn(Cc2ccccc2)c1=O

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.51
PPARG P37231 9/20 0.51
PPARD Q03181 2/20 0.45
ADORA3 P0DMS8 3/20 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
SCHEMBL3841188 0.92 PPARA (0.60) PPARAPPARGPPARD
SCHEMBL3844620 0.92 PPARA (0.48) PPARAPPARGPPARD
SCHEMBL3840790 0.90 PPARA (0.46) PPARAPPARGPPARD
SCHEMBL3841400 0.90 PPARA (0.49) PPARAPPARGPPARD
SCHEMBL3845359 0.89 PPARA (0.50) PPARAPPARGPPARD
SCHEMBL3848673 0.89 PPARA (0.44) PPARAPPARGPPARDADORA3
SCHEMBL3285837 0.88 PPARA (0.60) PPARAPPARGPPARD
SCHEMBL3847187 0.88 PPARA (0.44) PPARAPPARGPPARD
SCHEMBL3841481 0.87 PPARA (0.51) PPARAPPARGPPARD
SCHEMBL3844298 0.87 PPARA (0.51) PPARAPPARGPPARDADORA3

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