SCHEMBL4602397

SCHEMBL4602397

CCCCCCN1CC=CN(c2ccccc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.39
MGLL Q99685 1/20 0.39
GRM2 Q14416 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HTT P42858 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
EEF2K O00418 1/20 0.38
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37
OPRL1 P41146 1/20 0.37
NPC1 O15118 1/20 0.37
MITF O75030 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 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
SCHEMBL4602084 0.75 MGLL (0.40) FAAHMGLLALDH1A1CYP1A2CYP2D6
SCHEMBL4601323 0.75 MGLL (0.40) FAAHMGLLALDH1A1CYP1A2CYP2D6
SCHEMBL14917573 0.74 MGLL (0.38) FAAHMGLLMEN1KMT2AALDH1A1
SCHEMBL8686095 0.72 S1PR1 (0.60) GRM2MEN1KMT2ANPC1RAB9A
SCHEMBL4602393 0.70 DRD2 (0.52) GRM2MEN1KMT2ANPC1RAB9A
SCHEMBL10337687 0.69 GAA (0.35) FAAHMGLLMEN1KMT2AALDH1A1
SCHEMBL424020 0.68 ALDH1A1 (0.62) FAAHMGLLHTTALDH1A1CYP1A2
SCHEMBL2905468 0.67 MGLL (0.53) FAAHMGLLNPSR1HTTALDH1A1
SCHEMBL864256 0.66 HTT (0.46) FAAHHTTALDH1A1CYP1A2CYP2D6
SCHEMBL6779927 0.65 MGLL (0.50) FAAHMGLLHTTALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1694748-B1 METHOD OF MODIFYING A FLUOROPOLYMERIC SUBSTRATE AND COMPOSITE ARTICLES THEREBY 3M INNOVATIVE PROPERTIES CO (US) 2008-04-23 EP disclosed
US-7273531-B2 Method of modifying a fluoropolymeric substrate and composite articles thereby 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-09-25 US disclosed
EP-1694748-A1 METHOD OF MODIFYING A FLUOROPOLYMERIC SUBSTRATE AND COMPOSITE ARTICLES THEREBY 3M Innovative Properties Company (US) 2006-08-30 EP disclosed
WO-2005047373-A1 METHOD OF MODIFYING A FLUOROPOLYMERIC SUBSTRATE AND COMPOSITE ARTICLES THEREBY 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-05-26 WO disclosed
US-20050092429-A1 Method of modifying a fluoropolymeric substrate and composite articles thereby 3M INNOVATIVE PROPERTIES COMPANY 2005-05-05 US disclosed