SCHEMBL28333323

SCHEMBL28333323

COc1ccccc1NOC(C)=O

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.53
▸ ALDH1A1 P00352 4/20 0.50
▸ POLB P06746 3/20 0.50
▸ CASP6 P55212 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ MAPT P10636 4/20 0.49
▸ GAA P10253 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ MEN1 O00255 1/20 0.47

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
SCHEMBL11236491 0.83 KMT2A (0.48) KMT2AALDH1A1POLBCASP6TDP1
SCHEMBL28018573 0.81 KDM4E (0.52) KMT2AALDH1A1POLBCASP6TDP1
SCHEMBL28316834 0.81 ALDH1A1 (0.49) KMT2AALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL2763507 0.80 KMT2A (0.54) KMT2AALDH1A1POLBSMN1; SMN2MAPT
1,2-Dimethoxybenzene SCHEMBL28254681 0.78 CA1 (0.65) KMT2AALDH1A1POLBSMN1; SMN2KDM4E
SCHEMBL30356246 0.77 KMT2A (0.70) KMT2AALDH1A1POLBCASP6TDP1
SCHEMBL171580 0.77 KMT2A (0.70) KMT2AALDH1A1POLBCASP6TDP1
SCHEMBL28333337 0.77 GAA (0.49) KMT2AALDH1A1TDP1MAPTGAA
SCHEMBL14106778 0.76 CA1 (0.55) KMT2AALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL11652555 0.76 CA1 (0.55) KMT2AALDH1A1POLBSMN1; SMN2MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110407751-A The preparation method of N- Methoxyphenylamino methyl formate UNIV WUHAN SCIENCE & TECH 2019-11-05 — — CN claimed
CN-110407751-A The preparation method of N- Methoxyphenylamino methyl formate UNIV WUHAN SCIENCE & TECH 2019-11-05 — — CN disclosed
CN-110407751-A The preparation method of N- Methoxyphenylamino methyl formate UNIV WUHAN SCIENCE & TECH 2019-11-05 — — CN disclosed
CN-110407751-A The preparation method of N- Methoxyphenylamino methyl formate UNIV WUHAN SCIENCE & TECH 2019-11-05 — — CN disclosed
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