SCHEMBL8570408

SCHEMBL8570408

COC#Cc1ccc(OC)c(C23CC4CC(CC(C4)C2)C3)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 4/20 0.47
RARB P10826 3/20 0.47
RARG P13631 3/20 0.47
LMNA P02545 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
NR1I2 O75469 1/20 0.47
PGR P06401 1/20 0.47
HSPD1 P10809 1/20 0.47
GOT1 P17174 1/20 0.47
GLRA1 P23415 1/20 0.47
BLM P54132 1/20 0.47
HSPE1 P61604 1/20 0.47
HDAC11 Q96DB2 2/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 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
SCHEMBL566677 0.84 RARA (0.48) RARARARBRARGLMNATDP1
SCHEMBL9251196 0.84 RARA (0.51) RARARARBRARGLMNATDP1
SCHEMBL8621129 0.82 RARA (0.41) RARARARBRARGLMNATDP1
SCHEMBL8572221 0.81 RARA (0.55) RARARARBRARGLMNATDP1
SCHEMBL8567725 0.81 RARA (0.52) RARARARBRARGLMNATDP1
SCHEMBL8616987 0.79 RARA (0.65) RARARARBRARGLMNATDP1
SCHEMBL641031 0.79 RARB (0.67) RARARARBRARGLMNATDP1
SCHEMBL8618895 0.78 ERN1 (0.44) RARARARBRARGLMNATDP1
SCHEMBL8573064 0.77 RARB (0.62) RARARARBRARGLMNATDP1
SCHEMBL10014917 0.77 RARA (0.52) RARARARBRARGLMNATDP1

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-5798354-A COSMETIC, THERAPY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-08-25 US disclosed
EP-0679631-B1 Biaromatic acetylated, an adamantyl group containing compounds, pharmaceutical and cosmetic compositions containing them and their use CIRD GALDERMA (FR) 1998-05-06 EP disclosed
US-5574036-A Adamantyl-substituted polycyclic acetylene compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1996-11-12 US disclosed
EP-0679631-A1 Biaromatic acetylated, an adamantyl group containing compounds, pharmaceutical and cosmetic compositions containing them and their use CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1995-11-02 EP disclosed