SCHEMBL7794236

SCHEMBL7794236

CC1(C)CCC(C)(C)c2cc(C(=O)COc3cc(C(=O)O)ccc3I)ccc21

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 5/20 0.70
CYP3A4 P08684 4/20 0.70
CYP26B1 Q9NR63 4/20 0.70
RXRA P19793 11/20 0.52
RXRB P28702 9/20 0.52
RARB P10826 7/20 0.52
RARG P13631 6/20 0.52
RXRG P48443 6/20 0.52
RARA P10276 5/20 0.52
HNF4A P41235 1/20 0.47

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
SCHEMBL8092497 0.91 CYP26A1 (0.70) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL6732613 0.89 CYP3A4 (0.71) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7803974 0.89 CYP26A1 (0.55) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7810742 0.84 CYP26A1 (0.64) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7769473 0.84 CYP26A1 (0.50) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7769471 0.84 CYP26A1 (0.50) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL5078193 0.83 CYP26A1 (1.00) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7770208 0.81 CYP26A1 (0.47) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7770210 0.81 CYP26A1 (0.47) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL6733878 0.80 CYP3A4 (0.71) CYP26A1CYP3A4CYP26B1RXRARXRB

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-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