SCHEMBL8767211

SCHEMBL8767211

CCc1cc(/C=C(\C)c2ccc(OC)c(C3(C)CCCCC3)c2)ccc1C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 19/20 0.74
RARG P13631 19/20 0.74
RARA P10276 18/20 0.74
RXRA P19793 5/20 0.48
RXRB P28702 2/20 0.48
RXRG P48443 2/20 0.48
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
CYP26A1 O43174 1/20 0.44
GMNN O75496 1/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
POLB P06746 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
NFKB1 P19838 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL8766299 1.00 RARB (0.74) RARBRARGRARARXRARXRB
SCHEMBL8766308 1.00 RARB (0.74) RARBRARGRARARXRARXRB
SCHEMBL8766164 0.88 RARB (0.72) RARBRARGRARARXRARXRB
SCHEMBL8766418 0.88 RARB (0.72) RARBRARGRARARXRARXRB
SCHEMBL6379000 0.86 RARB (1.00) RARBRARGRARARXRARXRB
SCHEMBL8765844 0.86 RARB (1.00) RARBRARGRARARXRARXRB
SCHEMBL6378998 0.86 RARB (1.00) RARBRARGRARARXRARXRB
SCHEMBL8766428 0.81 RARB (0.76) RARBRARGRARARXRAKDM4E
SCHEMBL8766425 0.81 RARB (0.76) RARBRARGRARARXRAKDM4E
SCHEMBL8766303 0.81 RARB (0.76) RARBRARGRARARXRAKDM4E

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-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 claimed