SCHEMBL8839136

SCHEMBL8839136

C=CCOC(=O)c1ccc(NC(=O)C(O)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.52
RARG P13631 10/20 0.52
CYP26A1 O43174 7/20 0.52
CYP3A4 P08684 6/20 0.52
RARA P10276 9/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
CYP2C19 P33261 1/20 0.46
CYP26B1 Q9NR63 3/20 0.44
RXRA P19793 3/20 0.44
PGR P06401 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
TBXA2R P21731 1/20 0.43
BLVRB P30043 1/20 0.43
RXRB P28702 2/20 0.42

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
SCHEMBL8839149 0.89 RARB (0.45) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8100589 0.89 RARB (0.44) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8100801 0.89 RARB (0.44) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8458134 0.84 CYP26A1 (0.65) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL7887936 0.82 CYP26A1 (0.52) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL5080286 0.81 RARB (0.71) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8839344 0.81 CYP26A1 (0.54) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8839101 0.81 RXRA (0.48) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8106548 0.80 CYP3A4 (0.47) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL7876774 0.78 CYP26A1 (0.48) RARBRARGCYP26A1CYP3A4RARA

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
US-5688817-A SKIN DISORDERS, ANTIINFLAMMATORY AGENTS, IMMUNOLOGY AND RHEUMATIC DISORDERS CENTRE INT'L. DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1997-11-18 US disclosed
US-5668156-A TREATMENT OF WARTS, ACNE, PSORIASIS, CORNEOPATHIES, KETONES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1997-09-16 US disclosed
US-5597839-A TREATMENT OF SKIN DISORDERS OR ANTIINFLAMMATORY AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1997-01-28 US disclosed
US-5567721-A AROMATIC UREA COMPOUND FOR SKIN DISORDER, RHEUMATIC DISEASE, RESPIRATORY DISORDER AND EYE DISORDER CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 1996-10-22 US disclosed
US-5439925-A Skin disorders, rheumatic diseases CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1995-08-08 US disclosed
US-5387594-A Administering for topical and systemic treatment of CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1995-02-07 US disclosed