SCHEMBL10694993

SCHEMBL10694993

COc1ccc(CCN(C(=O)COC(C)=O)c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 4/20 0.54
CHRM1 P11229 4/20 0.54
CHRM3 P20309 4/20 0.54
ALOX5 P09917 2/20 0.53
CHRM2 P08172 1/20 0.50
CHRM4 P08173 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
OPRM1 P35372 1/20 0.44
RNF4 P78317 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.44
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
POLB P06746 1/20 0.44
LPAR1 Q92633 1/20 0.44
LPAR5 Q9H1C0 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL10693562 0.90 MEN1 (0.56) CHRM5CHRM1CHRM3ALOX5CHRM2
SCHEMBL10693518 0.87 RNF4 (0.58) CHRM1CHRM3CHRM2MEN1KMT2A
SCHEMBL10695458 0.86 PTGIR (0.52) CHRM5CHRM1CHRM3MEN1KMT2A
SCHEMBL10690647 0.84 CHRM5 (0.56) CHRM5CHRM1CHRM3CHRM2
SCHEMBL10693309 0.84 ALOX5 (0.58) CHRM5CHRM1CHRM3ALOX5CHRM2
SCHEMBL11225170 0.84 CHRM5 (0.60) CHRM5CHRM1CHRM3ALOX5CHRM2
SCHEMBL10690104 0.83 MEN1 (0.55) CHRM1ALOX5CHRM2MEN1KMT2A
SCHEMBL10694697 0.81 MEN1 (0.53) ALOX5MEN1KMT2ANPC1RAB9A
SCHEMBL10694263 0.76 CNR2 (0.54) MEN1KMT2ATRPM8NPC1RAB9A
SCHEMBL4560242 0.76 NPC1 (0.60) CHRM5CHRM1CHRM3ALOX5LPAR1

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 5 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
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