SCHEMBL8458134

SCHEMBL8458134

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

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 9/20 0.65
RARA P10276 8/20 0.65
RARB P10826 6/20 0.65
RARG P13631 6/20 0.65
CYP3A4 P08684 6/20 0.65
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
TSHR P16473 2/20 0.65
ALDH1A1 P00352 1/20 0.65
CYP1A2 P05177 1/20 0.65
CYP2C9 P11712 1/20 0.65
MAPK1 P28482 1/20 0.65
CYP2C19 P33261 1/20 0.65
CYP26B1 Q9NR63 4/20 0.61
PGR P06401 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
TBXA2R P21731 1/20 0.55
BLVRB P30043 1/20 0.55
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 3/20 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
SCHEMBL7887936 0.90 CYP26A1 (0.52) CYP26A1RARARARBRARGCYP3A4
SCHEMBL8457429 0.87 RARA (0.56) CYP26A1RARARARBRARGCYP3A4
SCHEMBL9007231 0.87 RARA (0.69) CYP26A1RARARARBRARGCYP3A4
SCHEMBL8839344 0.87 CYP26A1 (0.54) CYP26A1RARARARBRARGCYP3A4
SCHEMBL7876774 0.87 CYP26A1 (0.48) CYP26A1RARARARBRARGCYP3A4
SCHEMBL7876777 0.87 CYP26A1 (0.48) CYP26A1RARARARBRARGCYP3A4
SCHEMBL28527041 0.85 ALDH1A1 (0.66) CYP26A1RARARARBRARGCYP3A4
SCHEMBL8102463 0.85 CYP26A1 (0.47) CYP26A1RARARARBRARGCYP3A4
SCHEMBL8102461 0.85 CYP26A1 (0.47) CYP26A1RARARARBRARGCYP3A4
SCHEMBL8839136 0.84 RARB (0.52) CYP26A1RARARARBRARGCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869067-A TREATING DERMATOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1999-02-09 US disclosed
US-5753239-A Bi-aromatic compounds and pharmaceutical and cosmetic compositions CENTRE INTERNATIONAL DE RECHERCHES DEMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1998-05-19 US disclosed