SCHEMBL29250366

SCHEMBL29250366

Clc1cccc2snc(Br)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.40
MCL1 Q07820 1/20 0.40
OGG1 O15527 1/20 0.36
LMNA P02545 2/20 0.35
PDE10A Q9Y233 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
MAPT P10636 3/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 4/20 0.33
GAA P10253 2/20 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
SCHEMBL30425275 1.00 MAPK1 (0.40) MAPK1MCL1OGG1LMNAPDE10A
SCHEMBL2967033 0.79 MAPK1 (0.38) MAPK1MCL1OGG1LMNAPDE10A
SCHEMBL3820047 0.76 ALDH1A1 (0.48) MAPK1MCL1OGG1LMNAPDE10A
SCHEMBL2977917 0.76 ALDH1A1 (0.35) LMNAMAPTKDM4EALDH1A1EPAS1
SCHEMBL4128387 0.72 MAPK1 (0.33) MAPK1MCL1OGG1LMNAPDE10A
SCHEMBL4380910 0.71 MAPK1 (0.43) MAPK1MCL1OGG1HDAC3HDAC4
SCHEMBL350288 0.69 POLB (0.39) MAPK1MCL1OGG1LMNAHDAC3
SCHEMBL10167535 0.68 MMP3 (0.32) MAPK1MCL1LMNAPDE10AMAPT
SCHEMBL11095814 0.68 ALDH1A1 (0.39) MAPK1MCL1OGG1LMNAMAPT
SCHEMBL13615128 0.68 TYK2 (0.47) MAPK1MCL1OGG1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116323566-B Sulfanone compound and preparation method and medical application thereof 中国医药研究开发中心有限公司 2024-05-17 CN disclosed