SCHEMBL10694697

SCHEMBL10694697

CC(=O)OCC(=O)N(CCCCc1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NPC1 O15118 1/20 0.47
JAK2 O60674 1/20 0.47
RAB9A P51151 1/20 0.47
PAX8 Q06710 1/20 0.47
SIGMAR1 Q99720 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALOX5 P09917 4/20 0.44
ALDH1A1 P00352 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
TP53 P04637 1/20 0.43
MLYCD O95822 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
SCHEMBL10690104 0.97 MEN1 (0.55) MEN1KMT2ANPC1JAK2RAB9A
SCHEMBL10693562 0.90 MEN1 (0.56) MEN1KMT2ANPC1RAB9APAX8
SCHEMBL10695458 0.82 PTGIR (0.52) MEN1KMT2ANPC1JAK2RAB9A
SCHEMBL9676729 0.81 ALDH1A1 (0.59) MEN1KMT2ANPC1JAK2RAB9A
SCHEMBL10694993 0.81 CHRM5 (0.54) MEN1KMT2ANPC1RAB9AALOX5
SCHEMBL4456605 0.77 SMN1; SMN2 (0.52) MEN1KMT2ANPC1JAK2RAB9A
SCHEMBL11794701 0.77 ALDH1A1 (0.45) MEN1KMT2ANPC1JAK2RAB9A
SCHEMBL10694263 0.77 CNR2 (0.54) MEN1KMT2ANPC1JAK2RAB9A
SCHEMBL10991682 0.77 MEN1 (0.60) MEN1KMT2ANPC1JAK2RAB9A
SCHEMBL10690647 0.75 CHRM5 (0.56) ALDH1A1L3MBTL1

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