SCHEMBL30490281

SCHEMBL30490281

CNS(=O)(=O)c1cc(C2CC2)ccc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 6/20 0.40
HDAC2 Q92769 5/20 0.40
HDAC3 O15379 1/20 0.40
WDR5 P61964 1/20 0.38
LMNA P02545 3/20 0.37
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
BRD4 O60885 1/20 0.34
TRIM24 O15164 3/20 0.33
BRPF1 P55201 1/20 0.33
KCNH2 Q12809 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
XBP1 P17861 1/20 0.33
HTT P42858 1/20 0.33
PTGES2 Q9H7Z7 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
SCHEMBL20092262 0.81 HDAC1 (0.39) HDAC1HDAC2HDAC3WDR5L3MBTL1
SCHEMBL14454641 0.78 HDAC1 (0.42) HDAC1HDAC2HDAC3WDR5MAPT
SCHEMBL25289702 0.76 HDAC1 (0.36) HDAC1HDAC2HDAC3WDR5TYK2
SCHEMBL20093001 0.75 TYK2 (0.38) HDAC1HDAC2HDAC3L3MBTL1TYK2
SCHEMBL29739838 0.74 HDAC1 (0.37) HDAC1HDAC2HDAC3WDR5LMNA
SCHEMBL375209 0.73 ALDH1A1 (0.42) LMNAL3MBTL1SMN1; SMN2HTTPTGES2
SCHEMBL6130536 0.73 CA12 (0.50) LMNAL3MBTL1MAPTSMN1; SMN2HTT
SCHEMBL1522466 0.72 PTGES2 (0.48) HDAC1HDAC2HDAC3LMNAHTT
SCHEMBL2112353 0.72 QDPR (0.49)
SCHEMBL20092137 0.72 TYK2 (0.41) SMN1; SMN2TYK2

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-116283954-A Hydroxamate compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-06-23 CN disclosed