SCHEMBL26143786

SCHEMBL26143786

Oc1nc(N2CCOCC2)nc(O)c1-c1ccc2c(c1)OCO2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ PIK3CA P42336 4/20 0.47
▸ MTOR P42345 3/20 0.47
▸ PIK3CG P48736 2/20 0.47
▸ NPC1 O15118 4/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ HPGD P15428 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ TP53 P04637 2/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ADK P55263 1/20 0.44
▸ PIK3CB P42338 2/20 0.44
▸ FLT3 P36888 1/20 0.43
▸ WDR5 P61964 1/20 0.42
▸ MAPT P10636 3/20 0.42
▸ PIK3R1 P27986 1/20 0.42
▸ PIK3CD O00329 1/20 0.42
▸ GAA P10253 1/20 0.41

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
SCHEMBL26143787 0.84 KMT2A (0.55) KMT2AMEN1PIK3CAMTORPIK3CG
SCHEMBL26143792 0.76 ALDH1A1 (0.54) KMT2AMEN1NPC1SMN1; SMN2HPGD
SCHEMBL3724689 0.74 MEN1 (0.50) KMT2AMEN1PIK3CAMTORPIK3CG
SCHEMBL22404287 0.72 CYP3A4 (0.48) KMT2AMEN1PIK3CAPIK3CGNPC1
SCHEMBL29345068 0.71 MAPT (0.64) KMT2AMEN1SMN1; SMN2TP53MAPT
SCHEMBL28609409 0.71 MTOR (0.72) PIK3CAMTORPIK3CGPIK3CBPIK3CD
SCHEMBL18674639 0.70 AR (0.65) KMT2AMEN1NPC1SMN1; SMN2RAB9A
SCHEMBL17446308 0.70 TBK1 (0.61) ALDH1A1KDM4EMAPTALOX15TSHR
SCHEMBL19500868 0.69 MAPT (0.59) KMT2AMEN1NPC1HPGDRAB9A
SCHEMBL2814349 0.68 KDM4E (0.49) KMT2APIK3CAMTORPIK3CGSMN1; SMN2

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-2023078463-A1 AZOBENZENE COMPOUND AND APPLICATION THEREOF 正大天晴药业集团股份有限公司 2023-05-11 — — WO disclosed
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