SCHEMBL7709232

SCHEMBL7709232

COc1cc2c(cc1C(O)C#Cc1ccc(C(=O)O)c(O)c1)C(C)(C)CCC2(C)C

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 13/20 0.45
RARB P10826 4/20 0.42
RARG P13631 4/20 0.42
RARA P10276 3/20 0.42
CYP26A1 O43174 2/20 0.42
CYP3A4 P08684 2/20 0.42
CRABP2 P29373 1/20 0.42
HNF4A P41235 3/20 0.39
RXRB P28702 2/20 0.36
RXRG P48443 2/20 0.36
CYP26B1 Q9NR63 1/20 0.35

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
SCHEMBL7714841 0.91 RXRA (0.39) RXRARARBRARGRARACYP26A1
SCHEMBL7709299 0.87 RXRA (0.46) RXRARARBRARGRARACYP26A1
SCHEMBL7928405 0.87 RARG (0.51) RXRARARBRARGRARACYP26A1
SCHEMBL7753438 0.86 RARG (0.38) RXRARARBRARGRARACYP26A1
SCHEMBL7753439 0.86 RXRA (0.39) RXRARARBRARGRARACYP26A1
SCHEMBL6260318 0.82 RARB (0.50) RXRARARBRARGRARACYP26A1
SCHEMBL1991598 0.82 RARB (0.50) RXRARARBRARGRARACYP26A1
SCHEMBL6159273 0.82 RARB (0.50) RXRARARBRARGRARACYP26A1
SCHEMBL7713138 0.80 RXRA (0.39) RXRARARBRARGRARACYP26A1
SCHEMBL7928580 0.79 RARG (0.45) RXRARARBRARGRARACYP26A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6162445-A Polyaromatic propynyl compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-12-19 US claimed
EP-0661258-B1 Biaromatic propynyl compounds, pharmaceutical compositions and cosmetics containing them and their uses CIRD GALDERMA (FR) 1998-04-08 EP claimed
US-5716624-A USEFUL FOR TREATING DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, OPTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS/DISORDERS C.I.R.D. GALDERMA (FR) 1998-02-10 US claimed
EP-0661258-A1 Biaromatic propynyl compounds, pharmaceutical compositions and cosmetics containing them and their uses CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1995-07-05 EP claimed
US-6368608-B1 SKIN DISORDERS CENTRE INTERNATIONAL DE RECHERCHE DERMATOLOGIQUES GALDERMA (C.I.R.D.) (FR) 2002-04-09 US disclosed
US-6162445-A Polyaromatic propynyl compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-12-19 US disclosed
EP-0661258-B1 Biaromatic propynyl compounds, pharmaceutical compositions and cosmetics containing them and their uses CIRD GALDERMA (FR) 1998-04-08 EP disclosed
US-5716624-A USEFUL FOR TREATING DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, OPTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS/DISORDERS C.I.R.D. GALDERMA (FR) 1998-02-10 US disclosed
EP-0661258-A1 Biaromatic propynyl compounds, pharmaceutical compositions and cosmetics containing them and their uses CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1995-07-05 EP disclosed