SCHEMBL3433442

SCHEMBL3433442

Cn1cc(CC2COCCN2)c2cc(-c3ccccc3)ccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.45
CNR1 P21554 7/20 0.45
NR4A2 P43354 2/20 0.39
PARG Q86W56 1/20 0.35
LMNA P02545 1/20 0.34
OPRM1 P35372 2/20 0.34
OPRK1 P41145 2/20 0.34
OGFRL1 Q5TC84 2/20 0.34
OPRD1 P41143 1/20 0.34
OPRL1 P41146 1/20 0.34
SLC6A4 P31645 1/20 0.34
ICMT O60725 2/20 0.34
PRKDC P78527 1/20 0.33
CCNT1 O60563 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33

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
SCHEMBL3433438 1.00 CNR2 (0.45) CNR2CNR1NR4A2PARGLMNA
SCHEMBL944734 0.85 GPR84 (0.48) LMNAOPRM1OPRK1OGFRL1OPRD1
SCHEMBL947139 0.81 SLC6A4 (0.45) CNR2CNR1PARGOPRM1OPRK1
SCHEMBL945731 0.77 CNR2 (0.40) CNR2CNR1NR4A2PARGCCNT1
SCHEMBL3433332 0.77 CNR2 (0.40) CNR2CNR1NR4A2PARGCCNT1
SCHEMBL3434033 0.75 HTR1A (0.37) PARG
SCHEMBL21614275 0.68 NR4A2 (0.52) CNR2CNR1NR4A2ICMTCCNT1
SCHEMBL1176855 0.67 POLB (0.54) OPRM1OPRK1OGFRL1OPRD1OPRL1
SCHEMBL2333756 0.67 POLB (0.54) OPRM1OPRK1OGFRL1OPRD1OPRL1
SCHEMBL5408210 0.67 POLB (0.54) OPRM1OPRK1OGFRL1OPRD1OPRL1

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
WO-2010146351-A1 INDOLYLMETHYL-MORPHOLINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2010-12-23 WO disclosed