SCHEMBL10692590

SCHEMBL10692590

C=CCNC(=O)C(OC(C)=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
HPGD P15428 2/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 2/20 0.41
HTT P42858 2/20 0.41
GLA P06280 1/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40
CYP1A2 P05177 1/20 0.39
PKM P14618 1/20 0.38
MAPT P10636 2/20 0.38

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
SCHEMBL10694507 0.82 CNR1 (0.40) ALDH1A1LMNASMN1; SMN2HTTRAB9A
SCHEMBL10691473 0.79 RIPK1 (0.53) ALDH1A1HPGDLMNASMN1; SMN2GAA
SCHEMBL9501899 0.77 MMP8 (0.50) ALDH1A1HPGDSMN1; SMN2GAARAB9A
SCHEMBL10693365 0.75 CNR1 (0.54) ALDH1A1HPGDLMNASMN1; SMN2GAA
SCHEMBL10692779 0.75 POLB (0.61) HPGDSMN1; SMN2GAARAB9AKDM4E
SCHEMBL10994453 0.75 ACSS2 (0.41) ALDH1A1HPGDLMNAKDM4ECYP1A2
SCHEMBL10694465 0.75 SMN1; SMN2 (0.54) ALDH1A1HPGDLMNASMN1; SMN2GAA
SCHEMBL10694310 0.74 HDAC3 (0.43) ALDH1A1LMNASMN1; SMN2RAB9AKDM4E
SCHEMBL10692252 0.74 MEN1 (0.46) ALDH1A1HPGDLMNASMN1; SMN2GAA
SCHEMBL10694706 0.74 POLB (0.56) ALDH1A1HPGDLMNASMN1; SMN2POLB

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