SCHEMBL9655428

SCHEMBL9655428

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

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
LMNA P02545 2/20 0.61
TP53 P04637 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
ATM Q13315 1/20 0.54
NPSR1 Q6W5P4 1/20 0.44
MLYCD O95822 2/20 0.42
TRPM8 Q7Z2W7 2/20 0.42

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
SCHEMBL10695101 0.84 ALDH1A1 (0.43) ALDH1A1LMNATP53SMN1; SMN2MEN1
SCHEMBL8569247 0.84 KMT2A (0.46) ALDH1A1LMNATP53SMN1; SMN2MEN1
SCHEMBL10693508 0.80 KMT2A (0.53) ALDH1A1SMN1; SMN2MEN1KMT2AATM
SCHEMBL11775052 0.79 ALDH1A1 (0.59) ALDH1A1LMNATP53SMN1; SMN2MEN1
SCHEMBL11773794 0.79 ALDH1A1 (0.59) ALDH1A1LMNATP53SMN1; SMN2MEN1
SCHEMBL11778394 0.78 ALDH1A1 (0.58) ALDH1A1LMNATP53SMN1; SMN2MEN1
SCHEMBL8568846 0.78 KMT2A (0.63) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL12821356 0.78 ALDH1A1 (0.71) ALDH1A1LMNATP53SMN1; SMN2MEN1
SCHEMBL9403533 0.78 ALDH1A1 (0.71) ALDH1A1LMNATP53SMN1; SMN2MEN1
SCHEMBL28138500 0.77 ALDH1A1 (0.60) ALDH1A1LMNATP53SMN1; SMN2MEN1

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 7 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
EP-0098743-A1 Phenyl alpha-acyloxyacetamide derivates and their therapeutic use Yu, Ruey J., Dr. (US) 1984-01-18 EP claimed
US-5090991-A HERBICIDAL N-ISOPROPYLHETEROARYLOXYACETANILIDES BAYER AKATIENGESELLSCHAFT (DE) 1992-02-25 US disclosed
US-4968342-A PRE-AND POSTEMERGENCE BAYER AKTIENGESELLSCHAFT (DE) 1990-11-06 US disclosed
EP-0098743-B1 PHENYL ALPHA-ACYLOXYACETAMIDE DERIVATES AND THEIR THERAPEUTIC USE Yu, Ruey J., Dr. (US) 1988-09-28 EP disclosed
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