SCHEMBL31570127

SCHEMBL31570127

COc1ccc(NC(=O)CC(C)=O)c([N+](=O)[O-])c1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.69
▸ MEN1 O00255 5/20 0.69
▸ KMT2A Q03164 5/20 0.69
▸ SMN1; SMN2 Q16637 4/20 0.69
▸ RAB9A P51151 4/20 0.69
▸ NPC1 O15118 3/20 0.69
▸ POLB P06746 1/20 0.69
▸ MAPT P10636 8/20 0.68
▸ MAPK1 P28482 3/20 0.68
▸ GAA P10253 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ HPGD P15428 1/20 0.61
▸ RECQL P46063 1/20 0.61
▸ PKM P14618 1/20 0.59

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
SCHEMBL11776133 1.00 ALDH1A1 (0.69) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL31159573 0.86 MAPT (0.68) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL960290 0.86 MAPT (0.68) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL8784838 0.86 RAB9A (0.69) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL11441790 0.85 MAPT (0.60) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL8391902 0.83 MAPT (0.78) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL978809 0.83 RAB9A (0.73) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL978808 0.83 RAB9A (0.73) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL7917452 0.82 MAPK1 (0.80) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL5524662 0.82 RAB9A (0.71) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A

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-2025100475-A1 COMPOSITION FOR IMAGE RECORDING AND METHOD FOR PRODUCING SAME キヤノン株式会社 2025-05-15 — — WO disclosed
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