SCHEMBL7760403

SCHEMBL7760403

CCOC(=O)/C=C/c1cccc(/C(=N/O)c2cc3c(cc2C)C(C)(C)CCC3(C)C)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.54
RXRG P48443 16/20 0.54
RXRB P28702 15/20 0.54
BACE1 P56817 2/20 0.44
PTGS2 P35354 1/20 0.41
RARA P10276 3/20 0.41
RARB P10826 3/20 0.41
RARG P13631 3/20 0.41
MEN1 O00255 1/20 0.41
CYP26A1 O43174 1/20 0.41
ABCB11 O95342 1/20 0.41
ESR1 P03372 1/20 0.41
PGR P06401 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
CHRM1 P11229 1/20 0.41
DRD1 P21728 1/20 0.41
TBXA2R P21731 1/20 0.41
SLC6A2 P23975 1/20 0.41

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
SCHEMBL7760308 1.00 RXRA (0.54) RXRARXRGRXRBBACE1PTGS2
SCHEMBL7761273 0.90 CYP26A1 (0.45) RXRARXRGRXRBBACE1PTGS2
SCHEMBL7761560 0.90 CYP26A1 (0.45) RXRARXRGRXRBBACE1PTGS2
SCHEMBL7756564 0.88 RXRA (0.53) RXRARXRGRXRBBACE1PTGS2
SCHEMBL7756555 0.88 RXRA (0.53) RXRARXRGRXRBBACE1PTGS2
SCHEMBL7759739 0.87 RXRA (0.63) RXRARXRGRXRBRARARARB
SCHEMBL7762885 0.87 RXRA (0.63) RXRARXRGRXRBRARARARB
SCHEMBL7761551 0.80 RARA (0.51) RXRARXRGRXRBBACE1PTGS2
SCHEMBL7759779 0.80 RARA (0.51) RXRARXRGRXRBBACE1PTGS2
SCHEMBL6887779 0.78 RXRA (0.71) RXRARXRGRXRBRARARARB

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
EP-0915823-B1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CT INTERNAT DE (FR) 2001-04-18 EP claimed
US-6258775-B1 3-(3-(5,5,8,8-TETRAMATHYL-5,6,7,8-TETRAHYDRO-2-NAPHTYLCARBONYL )PHENYL)ACRYLIC ACID FOR TREATING DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2001-07-10 US disclosed