SCHEMBL8567726

SCHEMBL8567726

COc1ccc(C(=O)O)c(C#Cc2ccccc2)c1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.41
FAAH O00519 2/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
RARA P10276 3/20 0.40
RARB P10826 3/20 0.40
RARG P13631 3/20 0.40
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
PGR P06401 1/20 0.40
HSPD1 P10809 1/20 0.40
GOT1 P17174 1/20 0.40
GLRA1 P23415 1/20 0.40
BLM P54132 1/20 0.40
HSPE1 P61604 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.40
P2RX7 Q99572 1/20 0.39
GPR55 Q9Y2T6 1/20 0.38
EPHX2 P34913 1/20 0.37

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
SCHEMBL8570424 0.86 CNR2 (0.40) CNR2FAAHKMT2AMEN1RARA
SCHEMBL8567961 0.85 FAAH (0.47) CNR2FAAHKMT2AMEN1KDM4E
SCHEMBL8570623 0.84 RAB9A (0.38) CNR2FAAHKMT2AMEN1LMNA
SCHEMBL8570958 0.84 HIF1A (0.38) CNR2FAAHKMT2AMEN1RARA
SCHEMBL8566045 0.84 FAAH (0.41) CNR2FAAHKMT2AMEN1LMNA
SCHEMBL8566872 0.84 CNR2 (0.47) CNR2FAAHKMT2AMEN1NR1I2
SCHEMBL8569219 0.84 CNR2 (0.47) CNR2FAAHKMT2AMEN1NR1I2
SCHEMBL8567786 0.84 CNR2 (0.47) CNR2FAAHKMT2AMEN1NR1I2
SCHEMBL8572650 0.84 CNR2 (0.47) CNR2FAAHKMT2AMEN1NR1I2
SCHEMBL8570566 0.84 CNR1 (0.38) CNR2FAAHLMNAKDM4EEPHX2

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