SCHEMBL7759725

SCHEMBL7759725

CC1(C)CCC(C)(C)c2cc(C(NO)c3ccccc3C=CC(=O)O)ccc21

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 4/20 0.48
CYP3A4 P08684 3/20 0.47
RARA P10276 9/20 0.45
RARB P10826 8/20 0.45
RARG P13631 8/20 0.45
CYP26B1 Q9NR63 2/20 0.45
RXRA P19793 8/20 0.43
RXRB P28702 2/20 0.43
RXRG P48443 2/20 0.38

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
SCHEMBL7761315 0.86 RARA (0.39) CYP26A1CYP3A4RARARARBRARG
SCHEMBL7756683 0.85 RXRA (0.54) CYP26A1CYP3A4RARARARBRARG
SCHEMBL7756680 0.85 RXRA (0.54) CYP26A1CYP3A4RARARARBRARG
SCHEMBL7759870 0.85 RXRA (0.47) CYP26A1CYP3A4RARARARBRARG
SCHEMBL7759633 0.82 CYP26A1 (0.56) CYP26A1CYP3A4RARARARBRARG
SCHEMBL7759787 0.76 RXRA (0.54) CYP26A1CYP3A4RARARARBRARG
SCHEMBL7759790 0.76 RXRA (0.54) CYP26A1CYP3A4RARARARBRARG
SCHEMBL7889498 0.75 RXRA (0.52) CYP26A1CYP3A4RARARARBRARG
SCHEMBL7756631 0.75 RXRA (0.52) CYP26A1CYP3A4RARARARBRARG
SCHEMBL8458523 0.73 RXRA (0.66) CYP26A1CYP3A4RARARARBRARG

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