SCHEMBL6156487

SCHEMBL6156487

CC(C)(C)[Si](C)(C)OCc1ccc(COc2cccc(CCCCC(=O)O)c2)cc1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.50
CYSLTR1 Q9Y271 1/20 0.50
FFAR1 O14842 12/20 0.48
FFAR4 Q5NUL3 3/20 0.44
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
RXRA P19793 2/20 0.42
NR1H2 P55055 2/20 0.42
NR1H3 Q13133 1/20 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
SCHEMBL6878844 0.90 MTNR1A (0.41) CYSLTR2CYSLTR1FFAR1
SCHEMBL6158470 0.86 NOS1 (0.38) CYSLTR2CYSLTR1FFAR1CYP4F2CYP4A11
SCHEMBL6885569 0.80 FFAR1 (0.46) FFAR1FFAR4RXRANR1H2NR1H3
SCHEMBL6155407 0.79 CYSLTR2 (0.49) CYSLTR2CYSLTR1FFAR1FFAR4CYP4F2
SCHEMBL6885983 0.79 CYP3A4 (0.46) PPARGPPARA
SCHEMBL6155252 0.77 MAOB (0.52)
SCHEMBL5763262 0.76 FFAR1 (0.70) CYSLTR2CYSLTR1FFAR1FFAR4CYP4F2
SCHEMBL6156231 0.74 MAOB (0.41) CYP4F2CYP4A11
SCHEMBL4847215 0.74 CYSLTR2 (0.69) CYSLTR2CYSLTR1FFAR1FFAR4CYP4F2
SCHEMBL31385515 0.74 PPARD (0.41) FFAR1FFAR4CYP4F2CYP4A11PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP disclosed
US-6689922-B1 BIAROMATIC COMPOUNDS WHICH ARE ANALOGUES OF VITAMIN D HAVE A MARKED ACTIVITY IN THE FIELDS OF CELL DIFFERENTIATION AND PROLIFERATION GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2004-02-10 US disclosed
EP-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 WO disclosed