SCHEMBL7760189

SCHEMBL7760189

CC(c1cccc(C(=O)O)c1)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.78
RXRB P28702 5/20 0.78
RARB P10826 14/20 0.60
RARG P13631 13/20 0.60
RARA P10276 11/20 0.60
CYP26A1 O43174 3/20 0.53
CYP26B1 Q9NR63 2/20 0.53
CYP3A4 P08684 2/20 0.53
RXRG P48443 3/20 0.52

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
SCHEMBL7422602 0.87 RXRA (1.00) RXRARXRBRARBRARGRARA
SCHEMBL7896478 0.86 RXRA (0.61) RXRARXRBRARBRARGRARA
SCHEMBL7756480 0.83 RXRA (0.75) RXRARXRBRARBRARGRARA
SCHEMBL7129317 0.83 RXRA (0.54) RXRARXRBRARBRARGRARA
SCHEMBL7759792 0.82 RXRA (0.70) RXRARXRBRARBRARGRARA
SCHEMBL371525 0.81 ANPEP (0.58) RXRARXRBCYP3A4RXRG
SCHEMBL30354039 0.81 ANPEP (0.58) RXRARXRBCYP3A4RXRG
SCHEMBL8681591 0.80 RXRA (0.71) RXRARXRBRARBRARGRARA
Isophthalic Acid SCHEMBL25190289 0.79 ANPEP (0.56) RXRARXRBCYP3A4RXRG
SCHEMBL7756578 0.79 RXRA (0.58) RXRARXRBRARBRARGRARA

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 3 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 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