SCHEMBL8100714

SCHEMBL8100714

COC(=O)c1ccc(NC(=O)C(N)c2ccc3c(c2)C(C)(C)CCC3(C)C)s1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.40
RARG P13631 8/20 0.40
RARA P10276 7/20 0.40
RXRA P19793 5/20 0.40
RXRB P28702 4/20 0.40
CYP3A4 P08684 5/20 0.39
CYP26A1 O43174 4/20 0.39
RXRG P48443 3/20 0.38
CYP26B1 Q9NR63 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PPARG P37231 3/20 0.37

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
SCHEMBL8748608 0.91 RXRA (0.46) RARBRARGRARARXRARXRB
SCHEMBL8108628 0.81 RARB (0.36) RARBRARGRARARXRARXRB
SCHEMBL8100972 0.77 RARB (0.41) RARBRARGRARARXRARXRB
SCHEMBL8102291 0.75 RARB (0.39) RARBRARGRARARXRARXRB
SCHEMBL8748606 0.74 RARB (0.40) RARBRARGRARARXRARXRB
SCHEMBL8103042 0.74 RARB (0.47) RARBRARGRARARXRARXRB
SCHEMBL8556008 0.73 RXRA (0.48) RARBRARGRARARXRARXRB
SCHEMBL7709262 0.73 RXRA (0.43) RARBRARGRARARXRARXRB
SCHEMBL8758241 0.73 RARB (0.46) RARBRARGRARARXRARXRB
SCHEMBL8102916 0.72 RARB (0.51) RARBRARGRARARXRARXRB

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-0661260-B1 New bi-aromatic compounds derived from amides pharmaceutical compositions and cosmetic compositions containing them and their use CIRD GALDERMA (FR) 1997-03-12 EP claimed
US-6051243-A USEFUL IN THE TOPICAL AND SYSTEMIC TREATMENT OF DERMATOLOGICAL CONDITIONS ASSOCIATED WITH A KERATINIZATION DISORDER, DERMATOLOGICAL CONDITIONS (AND THE LIKE) INCLUDING AN INFLAMMATORY AND/OR IMMUNOALLERGIC COMPONENT CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2000-04-18 US disclosed
US-5709867-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-01-20 US disclosed