SCHEMBL28499587

SCHEMBL28499587

CCCCCCCCCCn1c(C)nc(-c2ccccc2)cc1=O

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.49
ENPP2 Q13822 1/20 0.47
GSK3B P49841 1/20 0.47
TLR8 Q9NR97 2/20 0.47
TSHR P16473 2/20 0.47
ADRA2A P08913 1/20 0.46

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
SCHEMBL29856754 0.82 TLR8 (0.49) ALDH1A1ENPP2TLR8ADRA2A
SCHEMBL30661772 0.80 TLR8 (0.51) ALDH1A1TLR8TSHR
SCHEMBL28499118 0.78 ADRA2A (0.47) ENPP2TLR8ADRA2A
SCHEMBL4739176 0.76 TSHR (0.50) ALDH1A1TSHRADRA2A
SCHEMBL8767485 0.75 ALDH1A1 (0.56) ALDH1A1GSK3B
SCHEMBL17401500 0.74 ENPP2 (0.77) ENPP2
SCHEMBL10843846 0.73 ALDH1A1 (0.59) ALDH1A1GSK3BTLR8
SCHEMBL28497863 0.73 ADRA2A (0.43) ALDH1A1ENPP2TLR8ADRA2A
SCHEMBL11788442 0.72 ALDH1A1 (0.84) ALDH1A1TLR8TSHR
SCHEMBL10526480 0.70 TSHR (0.74) ALDH1A1TSHR

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
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-117157285-A Pharmaceutical compounds as ubiquitin-specific protease 19 (USP 19) inhibitors 阿尔麦克探索有限公司 2023-12-01 CN disclosed
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