SCHEMBL7689447

SCHEMBL7689447

CC(C)Oc1ccc(C(=O)O)cc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.59
RARG P13631 11/20 0.59
RARA P10276 9/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
NR1I2 O75469 1/20 0.59
LMNA P02545 1/20 0.59
PGR P06401 1/20 0.59
HSPD1 P10809 1/20 0.59
GOT1 P17174 1/20 0.59
GLRA1 P23415 1/20 0.59
BLM P54132 1/20 0.59
HSPE1 P61604 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 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
SCHEMBL7691706 0.90 RARA (0.51) RARBRARGRARAMEN1KMT2A
SCHEMBL565789 0.85 RARA (0.77) RARBRARGRARAMEN1KMT2A
SCHEMBL1082340 0.85 RARA (0.77) RARBRARGRARAMEN1KMT2A
SCHEMBL8651200 0.84 RARA (0.48) RARBRARGRARAMEN1KMT2A
Hydrochloric Acid SCHEMBL9124255 0.84 RARA (0.76) RARBRARGRARAMEN1KMT2A
SCHEMBL8651203 0.83 RARA (0.47) RARBRARGRARAMEN1KMT2A
SCHEMBL7689477 0.82 RARA (0.52) RARBRARGRARAMEN1KMT2A
SCHEMBL7689475 0.82 RARA (0.52) RARBRARGRARAMEN1KMT2A
SCHEMBL5888168 0.81 RARB (0.53) RARBRARGRARAMEN1KMT2A
SCHEMBL8426145 0.80 RARA (0.63) RARBRARGRARAMEN1KMT2A

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-RE37947-E1 Aromatic polyenic compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2002-12-31 US disclosed
US-5705167-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-01-06 US disclosed