SCHEMBL8639253

SCHEMBL8639253

Cc1cc2c(cc1Sc1ccc([C]=O)cc1)C(C)(C)CCC2(C)C

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 17/20 0.65
RXRB P28702 10/20 0.65
RXRG P48443 10/20 0.65
RARB P10826 5/20 0.42
RARG P13631 5/20 0.42
CYP26A1 O43174 3/20 0.39
RARA P10276 4/20 0.37
CYP3A4 P08684 1/20 0.36
CRABP2 P29373 1/20 0.36
MEN1 O00255 1/20 0.35
ABCB11 O95342 1/20 0.35
ESR1 P03372 1/20 0.35
PGR P06401 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
DRD1 P21728 1/20 0.35
TBXA2R P21731 1/20 0.35
SLC6A2 P23975 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
SCHEMBL7760173 0.80 RXRA (0.69) RXRARXRBRXRGRARBRARG
SCHEMBL7721770 0.80 RXRA (0.65) RXRARXRBRXRGRARBRARG
SCHEMBL1073307 0.79 RXRA (1.00) RXRARXRBRXRGRARBRARG
SCHEMBL8617082 0.78 RXRA (0.78) RXRARXRBRXRGRARBRARG
SCHEMBL8014387 0.78 RXRA (0.78) RXRARXRBRXRGRARBRARG
SCHEMBL7720967 0.77 RXRA (0.65) RXRARXRBRXRGRARBRARG
SCHEMBL8015924 0.74 RXRA (0.71) RXRARXRBRXRGRARBRARG
SCHEMBL7716681 0.73 RXRA (0.70) RXRARXRBRXRGRARBRARG
SCHEMBL7720661 0.72 RXRA (0.69) RXRARXRBRXRGRARBRARG
SCHEMBL7723482 0.71 RXRA (0.67) RXRARXRBRXRGRARBRARG

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-0679630-B1 Bicyclic aromatic compounds, pharmaceutical and cosmetic compositions containing them and uses CIRD GALDERMA (FR) 1998-05-06 EP disclosed
EP-0679630-A1 Bicyclic aromatic compounds, pharmaceutical and cosmetic compositions containing them and uses CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1995-11-02 EP disclosed