SCHEMBL28015202

SCHEMBL28015202

CCOc1cccnc1N(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.46
ALDH1A1 P00352 2/20 0.42
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
PDE5A O76074 1/20 0.41
HTT P42858 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
LMNA P02545 2/20 0.38
ALOX12 P18054 1/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GLA P06280 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SYK P43405 1/20 0.38
MAPK10 P53779 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
SCHEMBL22084511 0.80 SMN1; SMN2 (0.49) GRM5ALDH1A1PDE5AHTTKMT2A
SCHEMBL22736821 0.80 PRMT5 (0.35) GRM5ALDH1A1PDE5AHTTKMT2A
SCHEMBL19687558 0.80 KDM4E (0.40) GRM5ALDH1A1PDE5AHTTKMT2A
SCHEMBL16741069 0.79 CTSS (0.41) GRM5ALDH1A1HTTL3MBTL1LMNA
SCHEMBL24310536 0.77 PRMT5 (0.33) GRM5ADRA2AADRA2BADRA2CHTT
SCHEMBL21500781 0.76 ALDH1A1 (0.36) ALDH1A1HTTKMT2AMEN1L3MBTL1
SCHEMBL18833817 0.76 CHRNB2 (0.49) GRM5ALDH1A1PDE5AHTTKMT2A
SCHEMBL19687559 0.75 KDM4E (0.40) ALDH1A1HTTKMT2AMEN1L3MBTL1
SCHEMBL19631332 0.75 KDM4E (0.41) ALDH1A1HTTL3MBTL1LMNAMAPT
SCHEMBL22737318 0.75 KDM4E (0.33) ALDH1A1HTTL3MBTL1LMNAALOX12

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
CN-103664741-B Preparation method of 2-acetonyl-3-methoxypiperidine GUANGZHOU WISDOM BIO TECHNOLOGY CO LTD 2015-04-29 CN claimed
CN-103664741-B Preparation method of 2-acetonyl-3-methoxypiperidine GUANGZHOU WISDOM BIO TECHNOLOGY CO LTD 2015-04-29 CN disclosed