SCHEMBL17852271

SCHEMBL17852271

CC(ON1C(C)(C)CC[C@@]1(C)c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 13/20 0.37
OPRK1 P41145 12/20 0.37
OPRL1 P41146 12/20 0.37
OPRD1 P41143 12/20 0.37
CYP2D6 P10635 3/20 0.35
GRIN2D O15399 2/20 0.33
GRIN3B O60391 2/20 0.33
GRIN1 Q05586 2/20 0.33
KCNH2 Q12809 2/20 0.33
GRIN2A Q12879 2/20 0.33
GRIN2B Q13224 2/20 0.33
GRIN2C Q14957 2/20 0.33
GRIN3A Q8TCU5 2/20 0.33
CYP2B6 P20813 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
PRCP P42785 1/20 0.33
SLC6A3 Q01959 1/20 0.33
SIGMAR1 Q99720 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
SCHEMBL15854882 0.92 OPRM1 (0.40) OPRM1OPRK1OPRL1OPRD1CYP2D6
SCHEMBL682099 0.81 CYP2D6 (0.36) OPRM1OPRK1OPRL1OPRD1CYP2D6
SCHEMBL28479357 0.76 CYP2D6 (0.37) OPRM1OPRK1OPRL1OPRD1CYP2D6
SCHEMBL5559192 0.73 NPSR1 (0.32) OPRM1OPRK1OPRL1OPRD1
SCHEMBL11949109 0.73 ATM (0.35) OPRM1OPRK1OPRL1OPRD1CYP2D6
SCHEMBL3388839 0.72 MEN1 (0.43) CYP2D6
SCHEMBL8853589 0.72 HPGD (0.31)
SCHEMBL13562982 0.71 LTB4R (0.32)
SCHEMBL17065143 0.71 OPRM1 (0.34) OPRM1OPRK1OPRL1OPRD1CYP2D6
SCHEMBL5560153 0.71 OPRM1 (0.34) OPRM1OPRK1OPRL1OPRD1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9771500-B2 Sealant composition for electronic device HENKEL AG & CO. KGAA (DE) 2017-09-26 US disclosed
US-9771500-B2 Sealant composition for electronic device HENKEL AG & CO. KGAA (DE) 2017-09-26 US disclosed
US-20160177148-A1 SEALANT COMPOSITION FOR ELECTRONIC DEVICE HENKEL AG & CO. KGAA (DE) 2016-06-23 US disclosed
US-20160177148-A1 SEALANT COMPOSITION FOR ELECTRONIC DEVICE HENKEL AG & CO. KGAA (DE) 2016-06-23 US disclosed