SCHEMBL7756544

SCHEMBL7756544

C=C(c1[c]cccc1)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.59
RARB P10826 11/20 0.59
RARG P13631 9/20 0.59
RXRB P28702 7/20 0.59
RARA P10276 5/20 0.59
RXRG P48443 5/20 0.59
CYP26A1 O43174 2/20 0.44
CYP26B1 Q9NR63 2/20 0.44
MEN1 O00255 1/20 0.44
ABCB11 O95342 1/20 0.44
ESR1 P03372 1/20 0.44
PGR P06401 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD1 P21728 1/20 0.44
TBXA2R P21731 1/20 0.44
SLC6A2 P23975 1/20 0.44
ADRA1A P35348 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
SCHEMBL7756615 0.83 RXRA (0.77) RXRARARBRARGRXRBRARA
SCHEMBL7759650 0.82 RXRA (0.59) RXRARARBRARGRXRBRARA
SCHEMBL8582315 0.81 RXRA (0.51) RXRARARBRARGRXRBRARA
SCHEMBL7761623 0.76 RARB (0.58) RXRARARBRARGRXRBRARA
SCHEMBL6818089 0.75 RXRA (1.00) RXRARARBRARGRXRBRARA
SCHEMBL7760199 0.74 RXRA (0.56) RXRARARBRARGRXRBRARA
SCHEMBL7761577 0.73 RXRA (0.70) RXRARARBRARGRXRBRARA
SCHEMBL8441787 0.73 RARB (0.57) RXRARARBRARGRXRBRARA
SCHEMBL12515953 0.73 RARB (0.66) RXRARARBRARGRXRBRARA
SCHEMBL3301372 0.73 RARB (0.61) RXRARARBRARGRXRBRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915823-B1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CT INTERNAT DE (FR) 2001-04-18 EP claimed
EP-0915823-A1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA (FR) 1999-05-19 EP claimed
WO-1998022423-A1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-05-28 WO claimed
EP-0915823-B1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CT INTERNAT DE (FR) 2001-04-18 EP disclosed
EP-0915823-A1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA (FR) 1999-05-19 EP disclosed
WO-1998022423-A1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-05-28 WO disclosed