SCHEMBL2858865

SCHEMBL2858865

CCCc1cc(C(=O)CC)ccc1-c1cc(OC(C)c2ccc(OC(=O)c3ccccc3)c(OC(=O)c3ccccc3)c2)ccc1CC

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.43
PPARA Q07869 15/20 0.43
PPARD Q03181 4/20 0.34
FFAR1 O14842 1/20 0.34
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL2852529 0.95 PPARA (0.37) PPARGPPARAPPARDFFAR1LTB4R
SCHEMBL2851882 0.92 PPARA (0.41) PPARGPPARAPPARDLTB4RLTB4R2
SCHEMBL2855102 0.89 PPARA (0.37) PPARGPPARAPPARDNPC1ALDH1A1
SCHEMBL2858864 0.74 VDR (0.49) PPARGPPARANPC1ALDH1A1RAB9A
SCHEMBL1022002 0.74 MTNR1A (0.44) PPARGPPARAALDH1A1
SCHEMBL13604875 0.73 VDR (0.45) PPARGPPARANPC1ALDH1A1SMN1; SMN2
SCHEMBL2863408 0.72 VDR (0.49) PPARGPPARANPC1ALDH1A1RAB9A
SCHEMBL2856534 0.69 VDR (0.42) PPARGPPARANPC1ALDH1A1RAB9A
SCHEMBL1022007 0.68 ALDH1A1 (0.42) PPARGPPARAALDH1A1
SCHEMBL2863404 0.68 VDR (0.68) PPARGPPARANPC1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456160-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2010-01-20 EP disclosed
EP-1456160-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2004-09-15 EP disclosed
WO-2003050067-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2003-06-19 WO disclosed