SCHEMBL8557728

SCHEMBL8557728

COC(=O)CC(=O)N(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.47
RXRB P28702 14/20 0.47
RXRG P48443 14/20 0.47
RARB P10826 2/20 0.39
RARG P13631 2/20 0.39
PTPN1 P18031 2/20 0.39
CYP26A1 O43174 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP26B1 Q9NR63 1/20 0.38
HNF4A P41235 1/20 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
SCHEMBL8555475 0.90 RXRA (0.49) RXRARXRBRXRGRARBRARG
SCHEMBL8555660 0.88 RXRA (0.47) RXRARXRBRXRGRARBRARG
SCHEMBL8556010 0.86 RXRA (0.49) RXRARXRBRXRGRARBRARG
SCHEMBL8555837 0.84 RXRA (0.46) RXRARXRBRXRGRARBRARG
SCHEMBL8100910 0.82 RXRA (0.60) RXRARXRBRXRGRARBRARG
SCHEMBL8556722 0.79 RXRA (0.43) RXRARXRBRXRGRARBRARG
SCHEMBL8559129 0.77 RXRA (0.45) RXRARXRBRXRGRARBRARG
SCHEMBL8353210 0.76 RXRA (0.45) RXRARXRBRXRGRARBRARG
SCHEMBL8555716 0.75 RXRA (0.44) RXRARXRBRXRGRARBRARG
SCHEMBL8352261 0.74 PTPN1 (0.39) RXRARXRBRXRGPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5709867-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-01-20 US claimed
US-5709867-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-01-20 US disclosed