SCHEMBL6795574

SCHEMBL6795574

CCCCCCCCCCCc1noc(-c2ccc(C(Cc3ccc(C(F)(F)F)cc3)OC(=O)NC(C)(C)C)cc2)n1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.45
PPARA Q07869 11/20 0.45
PPARD Q03181 6/20 0.45
SPHK1 Q9NYA1 1/20 0.43
SPHK2 Q9NRA0 1/20 0.39
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
SRC P12931 2/20 0.36

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
SCHEMBL6819754 0.85 HDAC1 (0.52) SPHK1HDAC1HDAC2
SCHEMBL6715546 0.80 PPARG (0.48) PPARGPPARAPPARDSPHK1SRC
SCHEMBL5049034 0.80 PPARG (0.44) PPARGPPARAPPARDSPHK1SPHK2
SCHEMBL27619640 0.79 SPHK1 (0.50) PPARGPPARAPPARDSPHK1SPHK2
SCHEMBL1850471 0.78 SPHK1 (0.49) PPARGPPARAPPARDSPHK1SPHK2
SCHEMBL5045607 0.77 NPC1 (0.41) PPARGPPARAPPARDSPHK1SPHK2
SCHEMBL1857189 0.76 SPHK1 (0.46) PPARGPPARAPPARDSPHK1SPHK2
SCHEMBL1856411 0.76 SPHK1 (0.46) PPARGPPARAPPARDSPHK1SPHK2
SCHEMBL1856616 0.76 SPHK1 (0.46) PPARGPPARAPPARDSPHK1SPHK2
SCHEMBL1855183 0.76 SPHK1 (0.51) PPARGPPARAPPARDSPHK1SPHK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1470102-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) Applied Research Systems ARS Holding N.V. (AN) 2004-10-27 EP disclosed
WO-2003064376-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-08-07 WO disclosed