SCHEMBL10692445

SCHEMBL10692445

CC(=O)OCC(=O)Nc1ccccc1CCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.61
ALDH1A1 P00352 4/20 0.57
HSD17B10 Q99714 1/20 0.57
MAPT P10636 2/20 0.49
RECQL P46063 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HPGD P15428 3/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
USP2 O75604 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 2/20 0.46
TSHR P16473 1/20 0.46
ABCB1 P08183 1/20 0.45
LMNA P02545 1/20 0.45
GLS O94925 1/20 0.45

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
SCHEMBL10693834 0.92 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1HSD17B10MAPTRECQL
SCHEMBL10689558 0.92 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1HSD17B10MAPTRECQL
SCHEMBL10693200 0.90 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1HSD17B10MAPTL3MBTL1
SCHEMBL10693447 0.89 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1HSD17B10MAPTL3MBTL1
SCHEMBL7796358 0.87 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1HSD17B10MAPTRECQL
SCHEMBL10690086 0.85 ALDH1A1 (0.56) ALDH1A1MAPTRECQLL3MBTL1HPGD
SCHEMBL10694565 0.84 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1HSD17B10MAPTHPGD
SCHEMBL10692685 0.83 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1HSD17B10KMT2AABCB1
SCHEMBL10690219 0.79 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1MAPTL3MBTL1HPGD
SCHEMBL10692647 0.78 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1HSD17B10MAPTRECQL

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