SCHEMBL10694599

SCHEMBL10694599

CCSC(O)Cc1ccccc1NC(=O)COC(C)=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.54
ALDH1A1 P00352 2/20 0.51
HSD17B10 Q99714 1/20 0.51
HPGD P15428 2/20 0.45
USP2 O75604 1/20 0.45
MAPT P10636 4/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 2/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 5/20 0.40
RECQL P46063 1/20 0.40
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL10694167 0.83 HDAC3 (0.43) ALDH1A1HSD17B10HPGDMAPTTSHR
SCHEMBL10693438 0.81 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1HSD17B10HPGDUSP2
SCHEMBL10694565 0.81 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1HSD17B10HPGDUSP2
SCHEMBL10991297 0.81 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1HSD17B10HPGDUSP2
SCHEMBL7796358 0.74 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1HSD17B10HPGDUSP2
SCHEMBL10692445 0.73 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1HSD17B10HPGDUSP2
SCHEMBL10693603 0.73 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1HSD17B10HPGDUSP2
SCHEMBL28756536 0.71 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1HSD17B10HPGDMAPT
SCHEMBL10692647 0.71 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1HSD17B10HPGDUSP2
SCHEMBL10689558 0.71 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1HSD17B10HPGDUSP2

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 3 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 claimed
US-4518789-A Phenyl alpha-acyloxyacetamide derivatives and their therapeutic use YU RUEY J 1985-05-21 US disclosed
EP-0098743-A1 Phenyl alpha-acyloxyacetamide derivates and their therapeutic use Yu, Ruey J., Dr. (US) 1984-01-18 EP disclosed