SCHEMBL7872176

SCHEMBL7872176

CC1(C)CCC(C)(C)c2cc(/C=C/C(=O)Oc3ccccc3C(=O)O)ccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.54
RARG P13631 9/20 0.54
RARA P10276 7/20 0.54
KDM4E B2RXH2 4/20 0.53
HSD17B10 Q99714 4/20 0.53
HPGD P15428 3/20 0.53
MAPT P10636 1/20 0.53
CYP26A1 O43174 3/20 0.47
RXRA P19793 7/20 0.46
ALDH1A1 P00352 3/20 0.44
KMT2A Q03164 2/20 0.44
CYP26B1 Q9NR63 1/20 0.44
CYP3A4 P08684 2/20 0.43
BLM P54132 2/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL7872185 1.00 RARB (0.54) RARBRARGRARAKDM4EHSD17B10
SCHEMBL7872249 0.84 CYP3A4 (0.43) RARBRARGRARAHSD17B10MAPT
SCHEMBL7872246 0.84 CYP3A4 (0.43) RARBRARGRARAHSD17B10MAPT
SCHEMBL7876418 0.83 KDM4E (0.52) RARBRARGRARAKDM4EHSD17B10
SCHEMBL7876412 0.83 KDM4E (0.52) RARBRARGRARAKDM4EHSD17B10
SCHEMBL7876430 0.81 RARB (0.74) RARBRARGRARAKDM4EHSD17B10
SCHEMBL7876428 0.81 RARB (0.74) RARBRARGRARAKDM4EHSD17B10
SCHEMBL7879935 0.80 RARB (0.60) RARBRARGRARAKDM4EHSD17B10
SCHEMBL7879932 0.80 RARB (0.60) RARBRARGRARAKDM4EHSD17B10
SCHEMBL7878351 0.79 RXRA (0.53) RARBRARGRARAKDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6326510-B1 SKIN DISORDERS; ANTICANCER AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2001-12-04 US claimed
US-6326510-B1 SKIN DISORDERS; ANTICANCER AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2001-12-04 US disclosed
EP-0901462-A1 BI-AROMATIC COMPOUNDS, COMPOSITIONS CONTAINING THEM AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1999-03-17 EP disclosed
WO-1998034909-A1 BI-AROMATIC COMPOUNDS, COMPOSITIONS CONTAINING THEM AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-08-13 WO disclosed