SCHEMBL8570424

SCHEMBL8570424

COCCCCCCOc1ccc(C(=O)O)c(C#Cc2ccccc2)c1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.40
FAAH O00519 3/20 0.40
CNR1 P21554 2/20 0.40
IKBKB O14920 2/20 0.37
RARA P10276 2/20 0.37
HIF1A Q16665 1/20 0.37
EPAS1 Q99814 1/20 0.37
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
P2RX7 Q99572 1/20 0.34
PTPN11 Q06124 2/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 1/20 0.34
NR1I2 O75469 1/20 0.34
PGR P06401 1/20 0.34
HSPD1 P10809 1/20 0.34

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
SCHEMBL8566872 0.92 CNR2 (0.47) CNR2FAAHCNR1LMNAPTPN11
SCHEMBL8569219 0.92 CNR2 (0.47) CNR2FAAHCNR1LMNAPTPN11
SCHEMBL8567786 0.92 CNR2 (0.47) CNR2FAAHCNR1LMNAPTPN11
SCHEMBL8572650 0.92 CNR2 (0.47) CNR2FAAHCNR1LMNAPTPN11
SCHEMBL8568941 0.91 CNR2 (0.39) CNR2FAAHCNR1RARAHIF1A
SCHEMBL8570566 0.90 CNR1 (0.38) CNR2FAAHCNR1HIF1AEPAS1
SCHEMBL8569983 0.90 CNR2 (0.38) CNR2FAAHCNR1HIF1AEPAS1
SCHEMBL8570958 0.89 HIF1A (0.38) CNR2FAAHCNR1RARAHIF1A
SCHEMBL8574818 0.89 HIF1A (0.37) CNR2FAAHCNR1IKBKBRARA
SCHEMBL8570623 0.87 RAB9A (0.38) CNR2FAAHCNR1HIF1AEPAS1

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