SCHEMBL8567959

SCHEMBL8567959

O=C(OC#Cc1ccc(OCc2ccccc2)c(C23CC4CC(CC(C4)C2)C3)c1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.43
CNR2 P34972 4/20 0.43
S1PR1 P21453 1/20 0.43
CNR1 P21554 1/20 0.43
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
EPHX2 P34913 6/20 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
NPSR1 Q6W5P4 1/20 0.39
RARA P10276 4/20 0.39
RARB P10826 3/20 0.39
RARG P13631 3/20 0.39
NR1I2 O75469 1/20 0.39
PGR P06401 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
SCHEMBL8566041 0.87 PDE4B (0.40) FAAHCNR2S1PR1CNR1MEN1
SCHEMBL8570955 0.87 RARA (0.40) S1PR1MEN1KMT2ALMNARARA
SCHEMBL8567725 0.86 RARA (0.52) FAAHCNR2S1PR1MEN1KMT2A
SCHEMBL8569229 0.86 FAAH (0.46) FAAHCNR2S1PR1CNR1MEN1
SCHEMBL8615102 0.86 RARA (0.48) FAAHCNR2S1PR1CNR1MEN1
SCHEMBL8570618 0.85 HIF1A (0.38) S1PR1MEN1KMT2ALMNARARA
SCHEMBL8568934 0.85 RARA (0.41) FAAHCNR2S1PR1CNR1MEN1
SCHEMBL8566865 0.85 CNR2 (0.43) FAAHCNR2CNR1MEN1KMT2A
SCHEMBL8572648 0.85 CNR2 (0.43) FAAHCNR2CNR1MEN1KMT2A
SCHEMBL8570420 0.85 RARA (0.45) FAAHCNR2S1PR1CNR1MEN1

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