SCHEMBL10692613

SCHEMBL10692613

O=C(Cc1ccccc1)OCC(=O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.64
ALDH1A1 P00352 3/20 0.56
MAPK1 P28482 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KMT2A Q03164 4/20 0.51
NPSR1 Q6W5P4 2/20 0.49
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
MEN1 O00255 2/20 0.45
TSHR P16473 1/20 0.45
PKM P14618 1/20 0.44
MAPT P10636 1/20 0.43
CASP1 P29466 1/20 0.43
KLK7 P49862 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
AKR1B1 P15121 1/20 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
SCHEMBL10693228 0.80 KMT2A (0.62) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL1792495 0.80 NPSR1 (0.61) ALDH1A1KMT2ANPSR1NPC1POLB
SCHEMBL5999038 0.78 PAM (0.78) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL1794881 0.78 NPSR1 (0.59) ALDH1A1KMT2ANPSR1NPC1POLB
SCHEMBL3748732 0.78 PAM (1.00) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL10693508 0.77 KMT2A (0.53) ALDH1A1L3MBTL1KMT2ANPSR1NPC1
SCHEMBL4947133 0.75 PAM (0.72) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL3673828 0.75 PAM (0.72) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL4947139 0.75 PAM (0.72) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL28033137 0.75 PAM (0.57) PAMALDH1A1MAPK1L3MBTL1KMT2A

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 4 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-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