SCHEMBL29635234

SCHEMBL29635234

CCOC(=O)c1cnc(N2CCOCC2)nc1C=CN(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.53
▸ ALOX15 P16050 1/20 0.52
▸ LMNA P02545 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ PKM P14618 1/20 0.45
▸ TP53 P04637 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ ADORA2A P29274 1/20 0.44
▸ MAPT P10636 5/20 0.43
▸ GAA P10253 3/20 0.43
▸ POLB P06746 3/20 0.43
▸ CNR2 P34972 1/20 0.43
▸ PIK3CA P42336 1/20 0.43
▸ DYRK1A Q13627 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42

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
SCHEMBL12929380 0.81 KDM4E (0.61) KDM4EALOX15LMNAALDH1A1PKM
SCHEMBL242697 0.80 KDM4E (0.61) KDM4EALOX15LMNAALDH1A1PKM
SCHEMBL244184 0.79 KDM4E (0.66) KDM4EALOX15LMNAALDH1A1PKM
SCHEMBL244096 0.79 KDM4E (0.60) KDM4EALOX15LMNAALDH1A1PKM
SCHEMBL28882232 0.78 CSNK1D (0.45) KDM4EALOX15LMNAALDH1A1TP53
SCHEMBL12279519 0.78 CSNK1D (0.45) KDM4EALOX15LMNAALDH1A1TP53
SCHEMBL13696639 0.78 KDM4E (0.59) KDM4EALOX15LMNAALDH1A1PKM
SCHEMBL14590419 0.77 MAPT (0.59) KDM4EALOX15LMNAALDH1A1PKM
SCHEMBL1012134 0.77 KDM4E (0.58) KDM4EALOX15LMNAALDH1A1PKM
SCHEMBL1014816 0.76 KDM4E (0.57) KDM4EALOX15LMNAALDH1A1PKM

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-108707151-B Pyrimido-pyridazinone compounds and uses thereof 阿萨纳生物科技有限责任公司 2022-06-03 — — CN disclosed
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