SCHEMBL28113848

SCHEMBL28113848

CCCCCCCCCCCCOC(=O)CC(C)(C)N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.60
HTR2C P28335 1/20 0.53
RAD52 P43351 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
FAAH O00519 2/20 0.50
DGKA P23743 1/20 0.50
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
EPHX1 P07099 1/20 0.47
TSHR P16473 3/20 0.46
HCAR2 Q8TDS4 1/20 0.43
S1PR4 O95977 1/20 0.43
S1PR1 P21453 1/20 0.43
S1PR3 Q99500 1/20 0.43
S1PR5 Q9H228 1/20 0.43
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL28114268 1.00 NAAA (0.60) NAAAHTR2CRAD52NPSR1FAAH
Hydrochloric Acid SCHEMBL11851939 0.90 NAAA (0.45) NAAAHTR2CRAD52NPSR1FAAH
SCHEMBL18856234 0.85 NAAA (0.64) NAAAHTR2CRAD52NPSR1FAAH
SCHEMBL26680181 0.85 NAAA (0.64) NAAAHTR2CRAD52NPSR1FAAH
SCHEMBL20260349 0.85 NAAA (0.64) NAAAHTR2CRAD52NPSR1FAAH
SCHEMBL9294112 0.83 NAAA (0.62) NAAAHTR2CRAD52NPSR1FAAH
SCHEMBL9294114 0.83 NAAA (0.62) NAAAHTR2CRAD52NPSR1FAAH
SCHEMBL15796763 0.83 NAAA (0.62) NAAAHTR2CRAD52NPSR1FAAH
SCHEMBL13602569 0.82 NAAA (0.61) NAAAHTR2CRAD52NPSR1FAAH
SCHEMBL18388527 0.81 NAAA (0.60) NAAAHTR2CRAD52NPSR1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106219968-A A kind of preparation method of blue tinted glass 云南鑫玻璃制品有限公司 2016-12-14 CN claimed
CN-103930105-B Active enantiomer of dodecyl 2- (N, N-dimethylamino) -propionate NEXMED HOLDINGS, INC. (US) 2019-11-01 CN disclosed
CN-103930105-B Active enantiomer of dodecyl 2- (N, N-dimethylamino) -propionate NEXMED HOLDINGS, INC. (US) 2019-11-01 CN disclosed
CN-106219968-B A kind of preparation method of blue tinted glass 云南鑫玻璃制品有限公司 2019-03-29 CN disclosed
CN-107614061-A For treating the antimigraine and illness method and composition relevant with pain 阿科莱尔斯疗法公司 2018-01-19 CN disclosed
CN-106219968-A A kind of preparation method of blue tinted glass 云南鑫玻璃制品有限公司 2016-12-14 CN disclosed