SCHEMBL8557721

SCHEMBL8557721

COC(=O)C(C(=O)NOC(=O)c1ccccc1)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.46
RXRB P28702 4/20 0.46
RARB P10826 8/20 0.45
RARG P13631 8/20 0.45
RARA P10276 5/20 0.45
PPARG P37231 3/20 0.43
CYP3A4 P08684 5/20 0.43
CYP26A1 O43174 4/20 0.43
CYP26B1 Q9NR63 1/20 0.43
HNF4A P41235 1/20 0.40
RXRG P48443 3/20 0.39

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
SCHEMBL8555653 0.91 RXRA (0.47) RXRARXRBRARBRARGRARA
SCHEMBL8556008 0.85 RXRA (0.48) RXRARXRBRARBRARGRARA
SCHEMBL8839167 0.85 RXRA (0.51) RXRARXRBRARBRARGRARA
SCHEMBL8555833 0.83 RXRA (0.46) RXRARXRBRARBRARGRARA
SCHEMBL8108587 0.80 RXRA (0.53) RXRARXRBRARBRARGRARA
SCHEMBL8555469 0.80 RXRA (0.49) RXRARXRBRARBRARGRARA
Hydrochloric Acid SCHEMBL8092985 0.79 RXRA (0.52) RXRARXRBRARBRARGRARA
SCHEMBL8557720 0.77 RARB (0.48) RXRARXRBRARBRARGRARA
SCHEMBL8100902 0.77 RARB (0.60) RXRARXRBRARBRARGRARA
SCHEMBL8092981 0.76 RXRA (0.52) 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 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