SCHEMBL9442181

SCHEMBL9442181

CCCCCC(C)(C)c1cc(Cc2ccccc2)cc(C(C)(C)CCCCC)c1O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.46
CNR1 P21554 12/20 0.46
GPR55 Q9Y2T6 4/20 0.46
GPR18 Q14330 3/20 0.46
KDM4E B2RXH2 3/20 0.40
HTT P42858 2/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
PTPN1 P18031 2/20 0.37
PTPN2 P17706 1/20 0.37
PTPN6 P29350 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
SCHEMBL9651445 0.88 PTPN1 (0.52) CNR2CNR1GPR55GPR18KDM4E
SCHEMBL5006946 0.83 MEN1 (0.42) LMNAMEN1GAAKMT2APTPN1
SCHEMBL10904865 0.81 CNR2 (0.40) CNR2CNR1GPR55GPR18HTT
SCHEMBL11025171 0.80 CNR1 (0.40) CNR2CNR1LMNATP53MEN1
SCHEMBL2338151 0.80 PTGS2 (0.43) CNR2CNR1HTTHPGDLMNA
SCHEMBL10904847 0.79 CNR2 (0.42) CNR2CNR1GPR55GPR18
SCHEMBL10904878 0.79 CNR2 (0.42) CNR2CNR1GPR55GPR18
SCHEMBL9063669 0.79 CNR1 (0.36) CNR2CNR1GPR55GPR18HTT
SCHEMBL11661680 0.79 HSPA5 (0.42) KDM4EHTTHPGDLMNATP53
SCHEMBL11028196 0.78 CNR1 (0.43) CNR2CNR1LMNATP53MEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5236979-A Containing synergistic mixture of tris/hydroxybenzyl/benzene and bis/alkylphenyl/pentaerythritol diphosphite ECP ENICHEM POLIMERI S.R.L. (IT) 1993-08-17 US disclosed