SCHEMBL9325641

SCHEMBL9325641

CCCCCCCNC(=O)OCc1ccccc1.O=C(O)Cl

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.64
HTT P42858 1/20 0.63
FAAH O00519 1/20 0.59
LMNA P02545 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
KEAP1 Q14145 2/20 0.57
NFE2L2 Q16236 2/20 0.57
SIRT2 Q8IXJ6 8/20 0.56
SIRT1 Q96EB6 5/20 0.56
SIRT3 Q9NTG7 4/20 0.55
MAPT P10636 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL10659971 0.96 HTT (0.68) TGM2HTTFAAHLMNASMN1; SMN2
SCHEMBL10599151 0.96 HTT (0.68) TGM2HTTFAAHLMNASMN1; SMN2
SCHEMBL3364812 0.96 HTT (0.68) TGM2HTTFAAHLMNASMN1; SMN2
SCHEMBL11973884 0.96 HTT (0.68) TGM2HTTFAAHLMNASMN1; SMN2
SCHEMBL16692630 0.96 HTT (0.68) TGM2HTTFAAHLMNASMN1; SMN2
SCHEMBL28969063 0.96 HTT (0.68) TGM2HTTFAAHLMNASMN1; SMN2
Bromide SCHEMBL29171369 0.94 HTT (0.67) TGM2HTTFAAHLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL29541034 0.94 HTT (0.67) TGM2HTTFAAHLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL30025835 0.94 HTT (0.67) TGM2HTTFAAHLMNASMN1; SMN2
SCHEMBL8290406 0.94 HTT (0.70) TGM2HTTFAAHLMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6092948-A None JP disclosed
JP-H0692948-A NOVEL ACETAMIDE DERIVATIVE AND ITS USE SNOW BRAND MILK PROD CO LTD 1994-04-05 JP disclosed