SCHEMBL28904255

SCHEMBL28904255

CCCCCCCCCCC1C(=O)N(C)CCN1S(C)(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.35
GBA1 P04062 1/20 0.33
CYP1A2 P05177 2/20 0.33
PRKCD Q05655 4/20 0.32
GRM2 Q14416 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
ALOX5 P09917 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PTGS2 P35354 4/20 0.30
PTGS1 P23219 3/20 0.30
MGLL Q99685 2/20 0.30
TP53 P04637 1/20 0.30
FAAH O00519 1/20 0.30

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
SCHEMBL28502803 0.80 CYP1A2 (0.37) GBA1CYP1A2PRKCDCHRNB2CHRNA7
SCHEMBL28490609 0.71 GRM2 (0.47) HSD17B10CYP1A2PRKCDGRM2ALDH1A1
SCHEMBL7887401 0.69 PTGS1 (0.42) GBA1CYP1A2PRKCDALDH1A1PTGS2
SCHEMBL31026188 0.68 CYP1A2 (0.41) GBA1CYP1A2CHRNB2CHRNA7CHRNA4
SCHEMBL4486955 0.68 CYP1A2 (0.41) GBA1CYP1A2CHRNB2CHRNA7CHRNA4
SCHEMBL3792450 0.68 CYP1A2 (0.41) GBA1CYP1A2CHRNB2CHRNA7CHRNA4
SCHEMBL21596445 0.68 CYP1A2 (0.41) GBA1CYP1A2CHRNB2CHRNA7CHRNA4
SCHEMBL8333332 0.68 CYP1A2 (0.41) GBA1CYP1A2CHRNB2CHRNA7CHRNA4
SCHEMBL17351114 0.68 ALOX5 (0.36) GBA1CYP1A2GRM2CHRNB2CHRNA7
SCHEMBL28510062 0.68 ALOX5 (0.36) GBA1CYP1A2GRM2CHRNB2CHRNA7

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