SCHEMBL10693527

SCHEMBL10693527

COc1ccc(Cc2ccccc2NC(=O)COC(C)=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.59
ALDH1A1 P00352 4/20 0.55
HSD17B10 Q99714 1/20 0.55
MAPT P10636 3/20 0.51
GAA P10253 2/20 0.51
KLK7 P49862 2/20 0.51
KMT2A Q03164 2/20 0.51
RAB9A P51151 2/20 0.51
USP2 O75604 1/20 0.51
TSHR P16473 1/20 0.51
MEN1 O00255 1/20 0.51
PKM P14618 1/20 0.51
POLB P06746 2/20 0.50
HCAR2 Q8TDS4 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
RECQL P46063 1/20 0.48
GRK2 P25098 1/20 0.47
PPARG P37231 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
NR2E3 Q9Y5X4 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
SCHEMBL10693447 0.89 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1HSD17B10MAPTGAA
SCHEMBL7796358 0.88 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1HSD17B10MAPTRAB9A
SCHEMBL10692647 0.87 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1HSD17B10MAPTRAB9A
SCHEMBL10691781 0.86 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1HSD17B10MAPTKMT2A
SCHEMBL10689596 0.86 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1HSD17B10MAPTRAB9A
SCHEMBL10690936 0.84 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1MAPTGAAKMT2A
SCHEMBL28220176 0.84 ALDH1A1 (0.58) SMN1; SMN2ALDH1A1GAAKMT2ARAB9A
SCHEMBL4681910 0.81 ALDH1A1 (0.62) SMN1; SMN2ALDH1A1MAPTGAAKMT2A
SCHEMBL10694565 0.80 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1HSD17B10MAPTKMT2A
SCHEMBL10694549 0.78 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1HSD17B10MAPTKMT2A

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-0098743-B1 PHENYL ALPHA-ACYLOXYACETAMIDE DERIVATES AND THEIR THERAPEUTIC USE Yu, Ruey J., Dr. (US) 1988-09-28 EP claimed