SCHEMBL10693892

SCHEMBL10693892

COc1ccc(CCNC(=O)C(OC(C)=O)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.57
FPR2 P25090 1/20 0.55
TAAR1 Q96RJ0 2/20 0.54
NPC1 O15118 1/20 0.54
GAA P10253 1/20 0.54
RAB9A P51151 1/20 0.54
PLAAT3 P53816 2/20 0.54
PLAAT5 Q96KN8 2/20 0.54
PLAAT2 Q9NWW9 2/20 0.54
PLAAT4 Q9UL19 2/20 0.54
PTPN1 P18031 1/20 0.54
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 1/20 0.50
MEN1 O00255 1/20 0.50
ATM Q13315 1/20 0.50
GLA P06280 1/20 0.49

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
SCHEMBL9501899 0.90 MMP8 (0.50) SMN1; SMN2TAAR1NPC1GAARAB9A
SCHEMBL10693154 0.88 NPC1 (0.54) NPC1RAB9AKMT2AALDH1A1MEN1
SCHEMBL10693248 0.86 TAAR1 (0.49) SMN1; SMN2TAAR1NPC1GAARAB9A
SCHEMBL10993323 0.85 ALDH1A1 (0.58) SMN1; SMN2NPC1RAB9APLAAT3PLAAT5
SCHEMBL10691686 0.82 FPR2 (0.60) SMN1; SMN2FPR2TAAR1NPC1GAA
SCHEMBL10692779 0.82 POLB (0.61) SMN1; SMN2TAAR1NPC1GAARAB9A
SCHEMBL10694706 0.81 POLB (0.56) SMN1; SMN2KMT2AALDH1A1
SCHEMBL10694773 0.78 MAPT (0.46) SMN1; SMN2TAAR1NPC1GAARAB9A
SCHEMBL10689506 0.77 MMP8 (0.48) SMN1; SMN2TAAR1NPC1GAARAB9A
SCHEMBL10691473 0.76 RIPK1 (0.53) SMN1; SMN2GAARAB9APTPN1ALDH1A1

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