SCHEMBL7884604

SCHEMBL7884604

CCCCCCCC/C=C(/C(=O)Nc1ccc(C(N)=O)cc1)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 9/20 0.46
RARB P10826 9/20 0.46
RARG P13631 9/20 0.46
CYP26A1 O43174 5/20 0.46
CYP3A4 P08684 4/20 0.46
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPK1 P28482 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
CYP26B1 Q9NR63 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
PGR P06401 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
TBXA2R P21731 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
SCHEMBL8348341 1.00 RARA (0.46) RARARARBRARGCYP26A1CYP3A4
SCHEMBL7884597 0.91 RARA (0.47) RARARARBRARGCYP26A1CYP3A4
SCHEMBL6429184 0.91 RARB (0.57) RARARARBRARGCYP26A1CYP3A4
SCHEMBL7881533 0.91 RARB (0.57) RARARARBRARGCYP26A1CYP3A4
SCHEMBL6429182 0.91 RARB (0.57) RARARARBRARGCYP26A1CYP3A4
SCHEMBL7876881 0.91 RARB (0.57) RARARARBRARGCYP26A1CYP3A4
SCHEMBL7884594 0.91 RARA (0.47) RARARARBRARGCYP26A1CYP3A4
SCHEMBL7876877 0.91 RARB (0.57) RARARARBRARGCYP26A1CYP3A4
SCHEMBL7876893 0.91 RARB (0.57) RARARARBRARGCYP26A1CYP3A4
SCHEMBL7876525 0.91 RARB (0.57) RARARARBRARGCYP26A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6171603-B1 TREATING SKIN, HAIR, CARDIOVASCULAR, AUTOIMMUNE AND VISION DISORDERS; ADMINISTERING AS ANTICARCINOGENIC, ANTIDEPRESSANT,ANTIINFLAMMATORY, AND ANTIACNE AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2001-01-09 US claimed
EP-0728739-B1 Biaromatic amide derivatives, pharmaceutical and cosmetic compositions containing them and their utilisations CIRD GALDERMA (FR) 1997-11-05 EP claimed
US-6171603-B1 TREATING SKIN, HAIR, CARDIOVASCULAR, AUTOIMMUNE AND VISION DISORDERS; ADMINISTERING AS ANTICARCINOGENIC, ANTIDEPRESSANT,ANTIINFLAMMATORY, AND ANTIACNE AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2001-01-09 US disclosed