SCHEMBL10698580

SCHEMBL10698580

CCCCCOC(C(N)=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
MMP13 P45452 1/20 0.47
CYP3A4 P08684 2/20 0.47
MEN1 O00255 1/20 0.47
NR1I2 O75469 1/20 0.47
CHRM2 P08172 1/20 0.47
ADRA2A P08913 1/20 0.47
MAPT P10636 1/20 0.47
OPRK1 P41145 1/20 0.47
HTR2B P41595 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
TSHR P16473 3/20 0.45
TP53 P04637 2/20 0.45

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
SCHEMBL9716936 0.98 NPC1 (0.49) LMNANPC1RAB9ASMN1; SMN2MMP9
SCHEMBL20538944 0.89 LMNA (0.43) LMNASMN1; SMN2CYP3A4MEN1CHRM2
SCHEMBL2406969 0.87 SMN1; SMN2 (0.50) LMNANPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL8081132 0.86 SMN1; SMN2 (0.51) LMNANPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL8081509 0.86 SMN1; SMN2 (0.51) LMNANPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL5508979 0.86 SMN1; SMN2 (0.51) LMNANPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL8081523 0.86 SMN1; SMN2 (0.51) LMNANPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL8072241 0.86 SMN1; SMN2 (0.51) LMNANPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL10639062 0.86 SMN1; SMN2 (0.51) LMNANPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL7556093 0.84 GLS (0.43) LMNASMN1; SMN2MEN1SLC6A3KMT2A

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 disclosed
EP-0098743-A1 Phenyl alpha-acyloxyacetamide derivates and their therapeutic use Yu, Ruey J., Dr. (US) 1984-01-18 EP disclosed
EP-0098743-A1 Phenyl alpha-acyloxyacetamide derivates and their therapeutic use Yu, Ruey J., Dr. (US) 1984-01-18 EP disclosed