SCHEMBL10864814

SCHEMBL10864814

CCOC=C(C(=O)OCC)C(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 1/20 0.49
▸ CES2 O00748 1/20 0.48
▸ MAPT P10636 8/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ LMNA P02545 5/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ MAPK1 P28482 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ TDP1 Q9NUW8 2/20 0.43
▸ MITF O75030 1/20 0.43
▸ POLB P06746 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
SCHEMBL8489318 0.89 CES2 (0.49) GLO1CES2MAPTALDH1A1KMT2A
SCHEMBL8489316 0.89 CES2 (0.49) GLO1CES2MAPTALDH1A1KMT2A
SCHEMBL10861577 0.84 ALDH1A1 (0.49) GLO1CES2MAPTALDH1A1KMT2A
SCHEMBL9382912 0.83 CES1 (0.49) GLO1CES2MAPTALDH1A1KMT2A
SCHEMBL9382917 0.83 CES1 (0.49) GLO1CES2MAPTALDH1A1KMT2A
SCHEMBL10864256 0.81 MAPT (0.47) GLO1CES2MAPTALDH1A1KMT2A
SCHEMBL9385161 0.81 GLO1 (0.58) GLO1CES2MAPTALDH1A1KMT2A
SCHEMBL9385166 0.81 GLO1 (0.58) GLO1CES2MAPTALDH1A1KMT2A
SCHEMBL10863731 0.81 MAPT (0.44) GLO1MAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL8494904 0.80 MAPT (0.47) GLO1MAPTALDH1A1KMT2ASMN1; 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
EP-0168733-A2 Process for the preparation of quinolinone and naphthyridoncarboxylic acids BAYER AG (DE) 1986-01-22 — — EP disclosed
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