SCHEMBL8567955

SCHEMBL8567955

O=C(O)c1ccccc1C#Cc1ccc(OCc2ccccc2)c(C23CC4CC(CC(C4)C2)C3)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.47
CNR2 P34972 4/20 0.47
CNR1 P21554 1/20 0.47
S1PR1 P21453 1/20 0.42
HIF1A Q16665 1/20 0.41
EPAS1 Q99814 1/20 0.41
FOLH1 Q04609 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTSV O60911 1/20 0.39
CTSL P07711 1/20 0.39
PTGER1 P34995 1/20 0.39
EPHX2 P34913 3/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL8566037 0.87 FAAH (0.42) FAAHCNR2CNR1S1PR1HIF1A
SCHEMBL8570953 0.87 RARA (0.39) FAAHCNR2CNR1S1PR1HIF1A
SCHEMBL8615102 0.87 RARA (0.48) FAAHCNR2CNR1S1PR1MEN1
SCHEMBL8567722 0.87 RARA (0.51) FAAHCNR2S1PR1HIF1AEPAS1
SCHEMBL8570613 0.86 RARA (0.38) FAAHCNR2CNR1S1PR1HIF1A
SCHEMBL8568931 0.86 RARA (0.40) FAAHCNR2CNR1S1PR1HIF1A
SCHEMBL8566864 0.85 CNR2 (0.47) FAAHCNR2CNR1MEN1KMT2A
SCHEMBL8566699 0.85 RARB (0.56) FAAHCNR2CNR1S1PR1HIF1A
SCHEMBL8570419 0.85 RARA (0.44) FAAHCNR2CNR1S1PR1HIF1A
SCHEMBL8567783 0.85 CNR2 (0.47) FAAHCNR2CNR1MEN1KMT2A

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-5798354-A COSMETIC, THERAPY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-08-25 US claimed
US-5798354-A COSMETIC, THERAPY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-08-25 US disclosed