SCHEMBL7799673

SCHEMBL7799673

CC(=O)c1ccc2c(c1)C(C)(c1ccc3c(c1)C(C)(C)CCC3(C)C)CO2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 15/20 0.50
RXRB P28702 7/20 0.50
CYP26A1 O43174 6/20 0.50
CYP26B1 Q9NR63 5/20 0.50
RARB P10826 8/20 0.45
RARG P13631 7/20 0.45
RXRG P48443 3/20 0.45
RARA P10276 6/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
NFKB1 P19838 1/20 0.43

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
SCHEMBL6730217 0.90 RXRA (0.57) RXRARXRBCYP26A1CYP26B1RARB
SCHEMBL6734636 0.87 CYP3A4 (0.51) RXRARXRBCYP26A1CYP26B1RARB
SCHEMBL7794000 0.87 RXRA (0.52) RXRARXRBCYP26A1CYP26B1RARB
SCHEMBL7793999 0.87 RXRA (0.52) RXRARXRBCYP26A1CYP26B1RARB
SCHEMBL7794003 0.87 RXRA (0.52) RXRARXRBCYP26A1CYP26B1RARB
SCHEMBL7799798 0.84 RARG (0.48) RXRARXRBCYP26A1CYP26B1RARB
SCHEMBL7802962 0.84 RARG (0.48) RXRARXRBCYP26A1CYP26B1RARB
SCHEMBL6733209 0.82 HPGD (0.47) RXRARXRBCYP26A1CYP26B1KDM4E
SCHEMBL6734359 0.82 CYP26A1 (0.57) RXRARXRBCYP26A1CYP26B1RARB
SCHEMBL6729166 0.81 RXRA (0.59) RXRARXRBCYP26A1CYP26B1RARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882033-B1 BENZOFURAN-ACRYLIC ACID DERIVATIVES AND THEIR USE AS MODULATORS OF RXRS OR RARS RECEPTORS CT INTERNAT DE RECH S (FR) 2001-08-16 EP disclosed
US-6030952-A AS HUMAN AND VETERINARY MEDICINE, PARTICULARLY IN THE TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR AND OPHTHALMOLOGIC CONDITIONS, AND IN COSMETIC COMPOSITIONS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIOUES GALDERMA (FR) 2000-02-29 US disclosed
EP-0882033-A1 BENZOFURAN-ACRYLIC ACID DERIVATIVES AND THEIR USE AS MODULATORS OF RXRS OR RARS RECEPTORS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1998-12-09 EP disclosed
WO-1998024778-A1 BENZOFURAN-ACRYLIC ACID DERIVATIVES AND THEIR USE AS MODULATORS OF RXRS OR RARS RECEPTORS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-06-11 WO disclosed