SCHEMBL30143824

SCHEMBL30143824

COC(=O)c1cc(CNC(=O)OC(C)(C)C)sc1OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.39
ATR Q13535 1/20 0.39
DYRK1A Q13627 1/20 0.38
HSD17B10 Q99714 3/20 0.36
SERPINE1 P05121 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
GFER P55789 1/20 0.36
GLS O94925 1/20 0.35
KDM4E B2RXH2 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
CACNA1H O95180 1/20 0.34
CACNA1B Q00975 1/20 0.34
CACNA1C Q13936 1/20 0.34
KCNA5 P22460 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34

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
SCHEMBL23413431 0.90 KDM4A (0.39) KDM4ADYRK1AHSD17B10SERPINE1L3MBTL1
SCHEMBL23413245 0.74 CRBN (0.48)
SCHEMBL8255339 0.74 HPGD (0.48) KDM4AATRDYRK1AL3MBTL1LMNA
SCHEMBL21411380 0.73 KDM4E (0.46) KDM4ADYRK1AL3MBTL1KDM4ELMNA
SCHEMBL23413121 0.72 ATR (0.40) KDM4AATRDYRK1AHSD17B10L3MBTL1
SCHEMBL29523614 0.72 CA12 (0.38) KDM4AL3MBTL1GLSKDM4ELMNA
SCHEMBL1205921 0.71 TSHR (0.47) KDM4AATRHSD17B10L3MBTL1GLS
SCHEMBL24822576 0.71 ALDH1A1 (0.50) L3MBTL1LMNAALDH1A1HPGDTSHR
SCHEMBL29523802 0.71 KDM4A (0.37) KDM4ASERPINE1L3MBTL1GLSKDM4E
SCHEMBL29035153 0.71 KDM4A (0.37) KDM4ADYRK1AL3MBTL1GLSKDM4E

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
WO-2022255890-A1 COMPOUNDS WHICH BIND TO CEREBLON, AND USE THEREOF CAPTOR THERAPEUTICS S.A. (PL) 2022-12-08 WO disclosed