SCHEMBL28510062

SCHEMBL28510062

CCCCCCCCCCC1NCCN(C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
GHSR Q92847 2/20 0.36
FAAH O00519 1/20 0.36
NAAA Q02083 1/20 0.36
CYP1A2 P05177 2/20 0.35
GNAO1 P09471 4/20 0.35
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GBA1 P04062 1/20 0.35
HLCS P50747 1/20 0.34
GNAI3 P08754 3/20 0.33
GNAI1 P63096 3/20 0.33
GRM2 Q14416 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
MGLL Q99685 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 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
SCHEMBL17351114 1.00 ALOX5 (0.36) ALOX5GHSRFAAHNAAACYP1A2
SCHEMBL3332909 0.93 ALDH1A1 (0.39) ALOX5GHSRFAAHNAAACYP1A2
SCHEMBL21815505 0.79 SLC6A2 (0.42) ALDH1A1
SCHEMBL28502803 0.73 CYP1A2 (0.37) ALOX5FAAHCYP1A2GNAO1ALDH1A1
SCHEMBL6861565 0.73 CYP1A2 (0.42) ALOX5CYP1A2ALDH1A1L3MBTL1GBA1
SCHEMBL3652550 0.73 CYP1A2 (0.42) ALOX5CYP1A2ALDH1A1L3MBTL1GBA1
SCHEMBL3792450 0.71 CYP1A2 (0.41) ALOX5FAAHCYP1A2GNAO1GBA1
SCHEMBL4486955 0.71 CYP1A2 (0.41) ALOX5FAAHCYP1A2GNAO1GBA1
SCHEMBL31026188 0.71 CYP1A2 (0.41) ALOX5FAAHCYP1A2GNAO1GBA1
SCHEMBL8333332 0.71 CYP1A2 (0.41) ALOX5FAAHCYP1A2GNAO1GBA1

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
CN-113365696-A Pharmaceutical compounds and their use as inhibitors of ubiquitin-specific protease 19(USP19) 阿尔麦克探索有限公司 2021-09-07 CN claimed
CN-112135818-A 4-hydroxypiperidine derivatives and their use as inhibitors of ubiquitin-specific protease 19(USP19) 阿尔麦克探索有限公司 2020-12-25 CN claimed
CN-113365696-A Pharmaceutical compounds and their use as inhibitors of ubiquitin-specific protease 19(USP19) 阿尔麦克探索有限公司 2021-09-07 CN disclosed
CN-112135818-A 4-hydroxypiperidine derivatives and their use as inhibitors of ubiquitin-specific protease 19(USP19) 阿尔麦克探索有限公司 2020-12-25 CN disclosed