SCHEMBL10694706

SCHEMBL10694706

CC(=O)OC(C(=O)NCCCCc1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
MMP8 P22894 2/20 0.53
KMT2A Q03164 4/20 0.49
HPGD P15428 2/20 0.49
ALDH1A1 P00352 1/20 0.49
TRPV1 Q8NER1 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MLYCD O95822 1/20 0.45
HSP90AA1 P07900 1/20 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
SCHEMBL10692779 0.96 POLB (0.61) POLBMMP8KMT2AHPGDSMN1; SMN2
SCHEMBL9501899 0.91 MMP8 (0.50) POLBMMP8HPGDALDH1A1SMN1; SMN2
SCHEMBL10693248 0.82 TAAR1 (0.49) KMT2AHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL10691473 0.82 RIPK1 (0.53) MMP8HPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL10693892 0.81 SMN1; SMN2 (0.57) KMT2AALDH1A1SMN1; SMN2
SCHEMBL10694507 0.79 CNR1 (0.40) KMT2AALDH1A1SMN1; SMN2LMNACYP2C19
SCHEMBL10694773 0.78 MAPT (0.46) POLBMMP8HPGDALDH1A1SMN1; SMN2
SCHEMBL10689506 0.77 MMP8 (0.48) POLBMMP8HPGDALDH1A1SMN1; SMN2
SCHEMBL14497820 0.77 POLB (0.90) POLBMMP8KMT2AHPGDALDH1A1
SCHEMBL10993323 0.76 ALDH1A1 (0.58) POLBKMT2AHPGDALDH1A1SMN1; SMN2

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