SCHEMBL8166114

SCHEMBL8166114

CCCCOC(=O)c1cccc2cc(Sc3ccc4c(c3)C(C)(C)CCC4(C)C)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 1/20 0.47
RXRA P19793 3/20 0.46
RXRB P28702 2/20 0.46
RXRG P48443 2/20 0.46
RARB P10826 1/20 0.46
RARG P13631 1/20 0.46
TSHR P16473 5/20 0.45
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALDH1A1 P00352 5/20 0.42
CYP3A4 P08684 2/20 0.42
MAPK1 P28482 2/20 0.42
TP53 P04637 1/20 0.41
HRH3 Q9Y5N1 2/20 0.41
HSD17B10 Q99714 2/20 0.41
LMNA P02545 1/20 0.41
TRPA1 O75762 2/20 0.38
KDM4E B2RXH2 2/20 0.38
DRD3 P35462 1/20 0.37
POLB P06746 1/20 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
SCHEMBL8165526 0.88 RXRA (0.48) RXRARXRBRXRGTSHRTDP1
SCHEMBL8165760 0.84 CYP26B1 (0.45) CYP26A1RXRARXRBRXRGTSHR
SCHEMBL8165521 0.83 TSHR (0.43) RXRARXRBRXRGRARBRARG
SCHEMBL8166267 0.81 RARB (0.62) CYP26A1RXRARXRBRXRGRARB
SCHEMBL17911601 0.78 CYP26A1 (0.55) CYP26A1RXRARXRBRXRGRARB
SCHEMBL29567408 0.78 CYP26A1 (0.55) CYP26A1RXRARXRBRXRGRARB
SCHEMBL8170066 0.77 RXRA (0.48) CYP26A1RXRARXRBRXRGTSHR
SCHEMBL17911584 0.75 CYP26A1 (0.67) CYP26A1RXRARXRBRXRGRARB
SCHEMBL29567511 0.75 CYP26A1 (0.67) CYP26A1RXRARXRBRXRGRARB
SCHEMBL27593647 0.75 TSHR (0.59) TSHRTDP1L3MBTL1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6156750-A Bioactive bicyclic aromatic compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-12-05 US disclosed
US-5985928-A HUMAN OR VETERINARY MEDICINE FOR EXAMPLE DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1999-11-16 US disclosed
US-5763487-A SKIN DISORDERS, CARDIOVASCULAR DISORDERS AND COSMETICS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-06-09 US disclosed
EP-0722928-B1 Bicyclic-aromatic compounds with strong biologic activity, pharmaceutical and cosmetic compositions containing them and uses thereof CIRD GALDERMA (FR) 1997-08-06 EP disclosed
EP-0722928-A1 Bicyclic-aromatic compounds with strong biologic activity, pharmaceutical and cosmetic compositions containing them and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1996-07-24 EP disclosed