SCHEMBL10692938

SCHEMBL10692938

CC(C)NC(=O)C(O)(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 3/20 0.50
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
GAA P10253 2/20 0.46
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
CASP3 P42574 1/20 0.43

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
SCHEMBL1206383 0.83 HDAC3 (0.47) LMNAALDH1A1CNR1CNR2GAA
SCHEMBL10332301 0.82 CYP2C9 (0.40) LMNAHTTL3MBTL1ALDH1A1CNR1
SCHEMBL27405464 0.81 MAPT (0.52) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL28625693 0.81 HDAC3 (0.63) LMNACNR1CNR2SMN1; SMN2HDAC3
SCHEMBL10332432 0.81 CYP2C9 (0.39) LMNAHTTL3MBTL1ALDH1A1CNR1
SCHEMBL24571259 0.79 KEAP1 (0.58) HTTL3MBTL1SMN1; SMN2HDAC3HDAC4
SCHEMBL10332431 0.79 ALDH1A1 (0.36) LMNAHTTL3MBTL1ALDH1A1CNR1
SCHEMBL4620848 0.78 HTT (0.56) LMNAHTTL3MBTL1ALDH1A1CNR1
SCHEMBL9473250 0.76 CNR1 (0.54) LMNAHTTL3MBTL1ALDH1A1CNR1
SCHEMBL2845025 0.75 HDAC3 (0.61) LMNAHTTL3MBTL1ALDH1A1CNR1

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
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