SCHEMBL7756501

SCHEMBL7756501

CC1(C)CCC(C)(C)c2cc(C(=O)c3cccc(I)c3)ccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 15/20 0.64
RARG P13631 13/20 0.64
RXRA P19793 11/20 0.64
RXRB P28702 7/20 0.64
RXRG P48443 5/20 0.64
RARA P10276 11/20 0.59
CYP26A1 O43174 5/20 0.59
CYP26B1 Q9NR63 1/20 0.59
CYP3A4 P08684 3/20 0.47
ALDH1A1 P00352 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
MEN1 O00255 1/20 0.47
CYP2C9 P11712 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
GMNN O75496 1/20 0.46

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
SCHEMBL16523407 0.86 RARB (0.74) RARBRARGRXRARXRBRXRG
SCHEMBL8733241 0.86 RARB (0.83) RARBRARGRXRARXRBRXRG
SCHEMBL7759698 0.85 RXRA (0.64) RARBRARGRXRARXRBRXRG
SCHEMBL2194599 0.84 RARB (0.82) RARBRARGRXRARXRBRXRG
SCHEMBL7761329 0.84 RARB (0.80) RARBRARGRXRARXRBRXRG
SCHEMBL7899482 0.80 RXRA (0.61) RARBRARGRXRARXRBRXRG
SCHEMBL24259973 0.78 RXRA (0.77) RARBRARGRXRARXRBRXRG
SCHEMBL10355871 0.78 RXRA (1.00) RARBRARGRXRARXRBRXRG
SCHEMBL7756637 0.78 RXRA (0.58) RARBRARGRXRARXRBRXRG
SCHEMBL3843601 0.77 ATM (0.60) ALDH1A1MEN1KMT2ANPC1MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0915823-B1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CT INTERNAT DE (FR) 2001-04-18 EP disclosed
EP-0915823-A1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA (FR) 1999-05-19 EP disclosed
WO-1998022423-A1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-05-28 WO disclosed