SCHEMBL19903081

SCHEMBL19903081

O=NC(=O)c1cccc2nsnc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.46
▸ HSD17B10 Q99714 4/20 0.46
▸ MAPT P10636 4/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ ALDH1A1 P00352 7/20 0.45
▸ HPGD P15428 5/20 0.45
▸ CASP1 P29466 2/20 0.45
▸ L3MBTL1 Q9Y468 4/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ HTT P42858 2/20 0.44
▸ ATM Q13315 1/20 0.44
▸ TXNRD1 Q16881 1/20 0.44
▸ TXNRD3 Q86VQ6 1/20 0.44
▸ TXNRD2 Q9NNW7 1/20 0.44
▸ KMT2A Q03164 5/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ POLB P06746 3/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43

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
SCHEMBL1338456 0.80 L3MBTL1 (0.61) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL14392300 0.79 KDM4E (0.53) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL1019293 0.79 HPGD (0.49) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL12956408 0.79 L3MBTL1 (0.58) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL12391731 0.75 POLB (0.51) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL27586118 0.75 HPGD (0.49) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL3753741 0.71 POLB (0.47) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL14256826 0.71 MAPT (0.52) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL25108756 0.70 RAB9A (0.45) KDM4EHSD17B10MAPTHIF1AALDH1A1
SCHEMBL3706219 0.68 SMN1; SMN2 (0.49) KDM4EHSD17B10MAPTALDH1A1HPGD

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
EP-3287454-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2018-02-28 — — EP disclosed
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