SCHEMBL8566872

SCHEMBL8566872

CCCCCCCCCOc1ccc(C(=O)O)c(C#Cc2ccccc2)c1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.47
CNR1 P21554 4/20 0.47
FAAH O00519 1/20 0.47
PTPN11 Q06124 5/20 0.42
S1PR3 Q99500 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
CYP2C9 P11712 1/20 0.39
MEN1 O00255 1/20 0.38
NR1I2 O75469 1/20 0.38
LMNA P02545 1/20 0.38
CHRM2 P08172 1/20 0.38
CYP3A4 P08684 1/20 0.38
ADRA2A P08913 1/20 0.38
MAPT P10636 1/20 0.38
OPRK1 P41145 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL8569219 1.00 CNR2 (0.47) CNR2CNR1FAAHPTPN11S1PR3
SCHEMBL8567786 1.00 CNR2 (0.47) CNR2CNR1FAAHPTPN11S1PR3
SCHEMBL8572650 1.00 CNR2 (0.47) CNR2CNR1FAAHPTPN11S1PR3
SCHEMBL8570424 0.92 CNR2 (0.40) CNR2CNR1FAAHPTPN11MEN1
SCHEMBL8568941 0.91 CNR2 (0.39) CNR2CNR1FAAHPTPN11LMNA
SCHEMBL8570566 0.90 CNR1 (0.38) CNR2CNR1FAAHLMNA
SCHEMBL8569983 0.90 CNR2 (0.38) CNR2CNR1FAAHPPARGPPARD
SCHEMBL8570958 0.89 HIF1A (0.38) CNR2CNR1FAAHMEN1LMNA
SCHEMBL8574818 0.89 HIF1A (0.37) CNR2CNR1FAAHCYP2C9LMNA
SCHEMBL8570623 0.87 RAB9A (0.38) CNR2CNR1FAAHPPARGMEN1

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