SCHEMBL10693790

SCHEMBL10693790

COc1ccc(CNC(=O)C(OC(C)=O)c2ccccc2)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.60
MEN1 O00255 2/20 0.60
ALDH1A1 P00352 3/20 0.56
PKM P14618 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
POLB P06746 1/20 0.51
GAA P10253 2/20 0.51
TSHR P16473 2/20 0.51
KDM4E B2RXH2 1/20 0.51
CYP3A4 P08684 1/20 0.51
ALOX15 P16050 1/20 0.51
RAB9A P51151 1/20 0.51
CTSD P07339 4/20 0.51
MAPK1 P28482 1/20 0.50

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
SCHEMBL10690654 0.88 KMT2A (0.59) KMT2AMEN1ALDH1A1SMN1; SMN2GAA
SCHEMBL10693524 0.84 KMT2A (0.70) KMT2AALDH1A1PKMTSHRRAB9A
SCHEMBL4158526 0.83 PKM (0.62) KMT2AMEN1ALDH1A1PKMTSHR
SCHEMBL4158522 0.83 PKM (0.62) KMT2AMEN1ALDH1A1PKMTSHR
SCHEMBL4162007 0.83 PKM (0.62) KMT2AMEN1ALDH1A1PKMTSHR
SCHEMBL6093048 0.83 ERCC1 (0.66) KMT2AMEN1ALDH1A1SMN1; SMN2POLB
SCHEMBL10692649 0.81 PKM (0.76) KMT2AMEN1ALDH1A1PKMSMN1; SMN2
SCHEMBL9502645 0.80 PKM (0.59) KMT2AMEN1ALDH1A1PKMTSHR
SCHEMBL10689090 0.80 ALDH1A1 (0.69) KMT2AMEN1ALDH1A1PKMTSHR
SCHEMBL9393592 0.77 MAPT (0.56) ALDH1A1SMN1; SMN2POLBTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0098743-B1 PHENYL ALPHA-ACYLOXYACETAMIDE DERIVATES AND THEIR THERAPEUTIC USE Yu, Ruey J., Dr. (US) 1988-09-28 EP disclosed
EP-0098743-A1 Phenyl alpha-acyloxyacetamide derivates and their therapeutic use Yu, Ruey J., Dr. (US) 1984-01-18 EP disclosed