SCHEMBL8765824

SCHEMBL8765824

C=C(C(=O)OC)c1ccc(-c2ccc3cc(C(=O)O)ccc3c2)cc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARG P13631 14/20 0.67
RARB P10826 13/20 0.67
RARA P10276 11/20 0.67
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
NR1I2 O75469 1/20 0.67
LMNA P02545 1/20 0.67
PGR P06401 1/20 0.67
HSPD1 P10809 1/20 0.67
GOT1 P17174 1/20 0.67
GLRA1 P23415 1/20 0.67
BLM P54132 1/20 0.67
HSPE1 P61604 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
KDM4E B2RXH2 1/20 0.63
ALDH1A1 P00352 1/20 0.63
TP53 P04637 1/20 0.63
CYP3A4 P08684 1/20 0.63
MAPT P10636 1/20 0.63
HPGD P15428 1/20 0.63

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
SCHEMBL5081241 0.87 RARG (0.72) RARGRARBRARAMEN1KMT2A
Hydrochloric Acid SCHEMBL9079139 0.86 RARG (0.71) RARGRARBRARAMEN1KMT2A
SCHEMBL8765846 0.86 RARB (0.50) RARGRARBRARAMEN1KMT2A
SCHEMBL8766318 0.85 RARG (0.77) RARGRARBRARAMEN1KMT2A
SCHEMBL8766397 0.83 RARB (0.66) RARGRARBRARAMEN1KMT2A
SCHEMBL6573658 0.82 RARG (0.72) RARGRARBRARAMEN1KMT2A
SCHEMBL9079134 0.81 RARB (0.60) RARGRARBRARAMEN1KMT2A
SCHEMBL8765785 0.81 RARG (0.68) RARGRARBRARAMEN1KMT2A
Adapalene SCHEMBL4302240 0.81 RARB (1.00) RARGRARBRARAMEN1KMT2A
Adapalene SCHEMBL2747 0.81 RARB (1.00) RARGRARBRARAMEN1KMT2A

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
EP-0584191-B1 NOVEL AROMATIC AND POLYCYCLIC COMPOUNDS AND THEIR USE IN HUMAN OR VETERINARY MEDICINE AND IN COSMETICS CIRD GALDERMA (FR) 1997-08-13 EP claimed
WO-1992019583-A1 NOVEL AROMATIC AND POLYCYCLIC COMPOUNDS AND THEIR USE IN HUMAN OR VETERINARY MEDECINE AND IN COSMETICS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1992-11-12 WO claimed
EP-0584191-B1 NOVEL AROMATIC AND POLYCYCLIC COMPOUNDS AND THEIR USE IN HUMAN OR VETERINARY MEDICINE AND IN COSMETICS CIRD GALDERMA (FR) 1997-08-13 EP disclosed
WO-1992019583-A1 NOVEL AROMATIC AND POLYCYCLIC COMPOUNDS AND THEIR USE IN HUMAN OR VETERINARY MEDECINE AND IN COSMETICS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1992-11-12 WO disclosed