SCHEMBL9824285

SCHEMBL9824285

CCC1(C)CC(=O)N(CCc2ccccc2)C1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
GAA P10253 3/20 0.50
MAPT P10636 2/20 0.50
HSD17B10 Q99714 2/20 0.50
HTT P42858 2/20 0.50
USP2 O75604 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GSK3A P49840 2/20 0.48
GSK3B P49841 2/20 0.48
MGLL Q99685 1/20 0.46
ALDH1A1 P00352 4/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
APAF1 O14727 1/20 0.43
CASP1 P29466 1/20 0.43
RAB9A P51151 1/20 0.43
BLM P54132 1/20 0.43
CASP7 P55210 1/20 0.43
ELANE P08246 2/20 0.43
SMN1; SMN2 Q16637 2/20 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
SCHEMBL9824381 0.85 ELANE (0.57) KMT2AMEN1GAAGSK3AGSK3B
SCHEMBL10862848 0.80 ELANE (0.51) KMT2AMEN1GAAGSK3AGSK3B
Hydrochloric Acid SCHEMBL9825096 0.79 MAOB (0.51) ACHE
SCHEMBL18538241 0.75 TSHR (0.42) ALDH1A1TSHRNPSR1
SCHEMBL28777070 0.75 KMT2A (0.51) KMT2AMEN1GAAMAPTHSD17B10
SCHEMBL9824067 0.74 TSHR (0.42) KMT2AMEN1GAAMAPTHSD17B10
SCHEMBL9824007 0.74 ALDH1A1 (0.43) KMT2AMEN1GAAHSD17B10ALDH1A1
SCHEMBL9823720 0.73 CHRM2 (0.49) KMT2AMEN1MAPTMGLLALDH1A1
SCHEMBL31306898 0.72 ALDH1A1 (0.51) KMT2AMEN1GAAMAPTL3MBTL1
SCHEMBL14359874 0.72 CHRM2 (0.35) ALDH1A1TSHRNPSR1

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
EP-0199963-B1 ETHOSUXIMIDE ASSAY TRACERS, IMMUNOGENS AND ANTIBODIES ABBOTT LABORATORIES (US) 1991-10-23 EP disclosed
EP-0199963-A1 Ethosuximide assay tracers, immunogens and antibodies ABBOTT LABORATORIES (US) 1986-11-05 EP disclosed