SCHEMBL10695101

SCHEMBL10695101

CC(=O)OCC(=O)N(c1ccccc1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
ATM Q13315 1/20 0.41
CYP3A4 P08684 1/20 0.40
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PTGIR P43119 1/20 0.37

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
SCHEMBL9655428 0.84 ALDH1A1 (0.61) ALDH1A1LMNASMN1; SMN2TP53KMT2A
SCHEMBL10693508 0.77 KMT2A (0.53) ALDH1A1SMN1; SMN2KMT2AMEN1ATM
SCHEMBL8568846 0.76 KMT2A (0.63) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL7621077 0.73 TDP1 (0.43) ALDH1A1LMNASMN1; SMN2TP53KMT2A
SCHEMBL11794701 0.72 ALDH1A1 (0.45) ALDH1A1LMNASMN1; SMN2TP53KMT2A
SCHEMBL10691887 0.72 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1CYP3A4
SCHEMBL9676729 0.71 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL8569247 0.70 KMT2A (0.46) ALDH1A1LMNASMN1; SMN2TP53KMT2A
SCHEMBL4437234 0.69 ALDH1A1 (0.47) ALDH1A1LMNASMN1; SMN2KMT2ACYP3A4
SCHEMBL10695198 0.69 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2TP53KMT2AMEN1

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 claimed
US-4518789-A Phenyl alpha-acyloxyacetamide derivatives and their therapeutic use YU RUEY J 1985-05-21 US disclosed