SCHEMBL8522801

SCHEMBL8522801

CC1C(C)(C)c2ccc(C(=O)c3ccc(C(=O)O)cc3)cc2C1(C)C

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 11/20 0.60
RARB P10826 6/20 0.60
RXRB P28702 6/20 0.60
RARG P13631 5/20 0.60
RXRG P48443 4/20 0.60
RARA P10276 4/20 0.49
CYP26A1 O43174 2/20 0.49
CYP26B1 Q9NR63 1/20 0.49
SRD5A2 P31213 7/20 0.48

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
SCHEMBL9746735 0.89 RARB (0.63) RXRARARBRXRBRARGRXRG
SCHEMBL10355822 0.85 RXRA (0.56) RXRARARBRXRBRARGRXRG
SCHEMBL10355823 0.83 CYP3A4 (0.43) RXRARARBRXRBRARGRXRG
SCHEMBL10356133 0.83 CYP26A1 (0.45) RXRARARBRXRBRARGRXRG
SCHEMBL10356205 0.83 RXRA (0.43) RXRARARBRXRBRARGRXRG
SCHEMBL8949891 0.82 CDC25B (0.55) RXRARARBRXRBRARGRXRG
SCHEMBL10458111 0.81 CDC25B (0.54) RXRARARBRXRBRARGRXRG
SCHEMBL10356204 0.81 AKR1C3 (0.46) RXRARARBRXRBRARGRXRG
SCHEMBL8776432 0.80 RARB (0.63) RXRARARBRARGRARACYP26A1
SCHEMBL8776390 0.80 RXRA (0.44) RXRARARBRXRBRARGRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0260162-B1 BICYCLIC AROMATIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA Groupement d'Intérêt Economique dit: (FR) 1990-11-14 EP claimed
WO-1999048529-A1 RETINOID-GLITAZONE COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-09-30 WO disclosed
EP-0808159-A1 USE OR RETINOIDS TO LOWER PLASMA LEVELS OF LIPOPROTEIN (a) WARNER-LAMBERT COMPANY (US) 1997-11-26 EP disclosed
WO-1996024344-A1 USE OF RETINOIDS TO LOWER PLASMA LEVELS OF LIPOPROTEIN (a) WARNER-LAMBERT COMPANY (US) 1996-08-15 WO disclosed
US-5489611-A ADMINISTERING A RETINOID COMPOUND WARNER-LAMBERT COMPANY (US) 1996-02-06 US disclosed
US-4833240-A SKIN DISORDERS; ANTIINFLAMMATORY AGENTS; ANTIALLLERGENS; ANTITUMOR AGENTS; OPHTHALMOLOGY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (CIRD) (FR) 1989-05-23 US disclosed