SCHEMBL8766282

SCHEMBL8766282

CC1(c2cc(/C=C/c3ccc(C(=O)O)cc3)ccc2O[Si](C)(C)C(C)(C)C)CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 16/20 0.53
RARG P13631 16/20 0.53
RARA P10276 15/20 0.53
RXRA P19793 5/20 0.43
NR2E1 Q9Y466 1/20 0.43
PTGDR Q13258 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
PTPN11 Q06124 1/20 0.36
TP53 P04637 2/20 0.35
CYP3A4 P08684 2/20 0.35
BLM P54132 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HSD17B10 Q99714 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
CYP26A1 O43174 1/20 0.35
GMNN O75496 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL8766289 1.00 RARB (0.53) RARBRARGRARARXRANR2E1
SCHEMBL9077146 0.88 RARB (0.54) RARBRARGRARARXRAPTGDR
SCHEMBL9078565 0.87 RARA (0.41) RARBRARGRARAPTGDRPTGDR2
SCHEMBL9078563 0.87 RARA (0.41) RARBRARGRARAPTGDRPTGDR2
SCHEMBL8766783 0.87 RARB (0.73) RARBRARGRARARXRATP53
SCHEMBL8766209 0.87 RARB (0.73) RARBRARGRARARXRATP53
SCHEMBL8766206 0.87 RARB (0.73) RARBRARGRARARXRATP53
SCHEMBL8766888 0.82 RARA (0.40) RARBRARGRARAPTGDRPTGDR2
SCHEMBL8766766 0.81 RARB (0.47) RARBRARGRARAPTGDRPTGDR2
SCHEMBL8766145 0.80 RARA (0.61) RARBRARGRARARXRANR2E1

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-0584191-B1 NOVEL AROMATIC AND POLYCYCLIC COMPOUNDS AND THEIR USE IN HUMAN OR VETERINARY MEDICINE AND IN COSMETICS CIRD GALDERMA (FR) 1997-08-13 EP disclosed
EP-0584191-A1 NOVEL AROMATIC AND POLYCYCLIC COMPOUNDS AND THEIR USE IN HUMAN OR VETERINARY MEDECINE AND IN COSMETICS. CIRD GALDERMA (FR) 1994-03-02 EP disclosed
WO-1992019583-A1 NOVEL AROMATIC AND POLYCYCLIC COMPOUNDS AND THEIR USE IN HUMAN OR VETERINARY MEDECINE AND IN COSMETICS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1992-11-12 WO disclosed