SCHEMBL7790069

SCHEMBL7790069

Cc1cc2c(cc1-c1cc(-c3ccc(C(=O)O)cc3)ccc1OS(=O)(=O)C(F)(F)F)C(C)(C)CCC2(C)C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARG P13631 15/20 0.67
RARB P10826 14/20 0.67
RXRA P19793 7/20 0.67
RARA P10276 12/20 0.54
RXRB P28702 3/20 0.47
RXRG P48443 3/20 0.47
CYP26A1 O43174 2/20 0.45
MEN1 O00255 1/20 0.45
ABCB11 O95342 1/20 0.45
ESR1 P03372 1/20 0.45
PGR P06401 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CHRM1 P11229 1/20 0.45
DRD1 P21728 1/20 0.45
TBXA2R P21731 1/20 0.45
SLC6A2 P23975 1/20 0.45
ADRA1A P35348 1/20 0.45
OPRM1 P35372 1/20 0.45

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
SCHEMBL5847370 0.90 RARG (0.53) RARGRARBRXRARARARXRB
SCHEMBL3679095 0.88 RARG (0.71) RARGRARBRXRARARA
SCHEMBL7789667 0.87 RARB (0.66) RARGRARBRXRARARARXRB
SCHEMBL7790045 0.86 RARG (0.56) RARGRARBRXRARARA
SCHEMBL5846356 0.79 RARG (0.61) RARGRARBRXRARARA
SCHEMBL497952 0.79 RARG (0.56) RARGRARBRXRARARA
SCHEMBL7784235 0.79 RARB (0.61) RARGRARBRXRARARARXRB
SCHEMBL5847730 0.79 RARG (0.46) RARGRARBRXRARARA
SCHEMBL7790097 0.78 RARG (0.83) RARGRARBRXRARARARXRB
SCHEMBL5846367 0.78 RARG (0.52) RARGRARBRXRARARA

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-0952974-B1 BIPHENYL DERIVATIVES SUBSTITUTED BY AN AROMATIC OR HETEROAROMATIC RADICAL AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RES & DEV (FR) 2001-11-21 EP disclosed