SCHEMBL30568581

SCHEMBL30568581

NC(=O)c1sc2cnccc2c1N1Cc2ccccc2C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
HTT P42858 2/20 0.42
HPGD P15428 2/20 0.42
GAA P10253 2/20 0.42
ALDH1A1 P00352 1/20 0.42
GLA P06280 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
NCOA1 Q15788 1/20 0.42
HSD17B10 Q99714 1/20 0.42
RCE1 Q9Y256 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
LIMK1 P53667 6/20 0.38
CHEK1 O14757 3/20 0.38
AURKA O14965 2/20 0.38
DAPK3 O43293 2/20 0.38
PIM1 P11309 2/20 0.38
FGFR1 P11362 2/20 0.38
PRKACA P17612 2/20 0.38
FLT1 P17948 2/20 0.38

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
SCHEMBL30568656 0.90 LIMK1 (0.40) KDM4EHTTHPGDGAAALDH1A1
SCHEMBL30568674 0.84 LIMK1 (0.54) KDM4EHPGDGAAALDH1A1GLA
SCHEMBL30568658 0.78 LIMK1 (0.33) HPGDLIMK1CHEK1AURKADAPK3
SCHEMBL30568671 0.73 ALDH1A1 (0.43) KDM4EALDH1A1LIMK1IKBKB
SCHEMBL15512118 0.72 KDM4E (0.68) KDM4EHTTHPGDGAAALDH1A1
SCHEMBL660147 0.71 KDM4E (0.51) KDM4EHTTHPGDGAAALDH1A1
SCHEMBL7797444 0.69 ICAM1 (0.52) KDM4EHTTHPGDGAAALDH1A1
SCHEMBL5554265 0.68 KDM4E (0.43) KDM4EHTTHPGDGAAALDH1A1
SCHEMBL19769208 0.68 MAPT (0.40) KDM4EHTTHPGDALDH1A1LIMK1
SCHEMBL5554164 0.68 KDM4E (0.42) KDM4EHTTHPGDGAAALDH1A1

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-116730995-A Hydrazide compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-09-12 CN disclosed