SCHEMBL8567780

SCHEMBL8567780

CCCCCCCCCCCCOc1ccc(C#COC(=O)c2ccccc2)cc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.43
FAAH O00519 1/20 0.43
CNR1 P21554 1/20 0.43
PPARG P37231 4/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
RARA P10276 3/20 0.41
RARB P10826 2/20 0.41
RARG P13631 2/20 0.41
MEN1 O00255 1/20 0.41
NR1I2 O75469 1/20 0.41
LMNA P02545 1/20 0.41
PGR P06401 1/20 0.41
HSPD1 P10809 1/20 0.41
GOT1 P17174 1/20 0.41
GLRA1 P23415 1/20 0.41
BLM P54132 1/20 0.41
HSPE1 P61604 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL8572648 1.00 CNR2 (0.43) CNR2FAAHCNR1PPARGPPARD
SCHEMBL8569216 1.00 CNR2 (0.43) CNR2FAAHCNR1PPARGPPARD
SCHEMBL8566865 1.00 CNR2 (0.43) CNR2FAAHCNR1PPARGPPARD
SCHEMBL8570420 0.93 RARA (0.45) CNR2FAAHCNR1PPARGPPARD
SCHEMBL8568934 0.92 RARA (0.41) CNR2FAAHCNR1PPARGPPARD
SCHEMBL8569980 0.90 RARA (0.38) CNR2FAAHCNR1PPARGPPARD
SCHEMBL8570955 0.90 RARA (0.40) PPARGPPARARARARARBRARG
SCHEMBL8574814 0.88 RARA (0.39) PPARGPPARARARARARBRARG
SCHEMBL8570618 0.88 HIF1A (0.38) PPARGPPARARARARARBRARG
SCHEMBL8572743 0.87 CNR2 (0.43) CNR2FAAHCNR1PPARGPPARD

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