SCHEMBL6220719

SCHEMBL6220719

CCC(=O)CN1CCCCCC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
ALDH1A1 P00352 7/20 0.48
HTT P42858 1/20 0.47
POLB P06746 2/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 2/20 0.42
MAOB P27338 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP1A2 P05177 1/20 0.39
MAPK1 P28482 1/20 0.39
GLA P06280 1/20 0.39
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL9979988 1.00 GAA (0.52) GAAALDH1A1HTTPOLBMAPT
SCHEMBL8809555 0.98 GAA (0.48) GAAALDH1A1HTTPOLBMAPT
SCHEMBL12233164 0.93
SCHEMBL16076280 0.87 TDP1 (0.47) GAAALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL19268642 0.87 TDP1 (0.47) GAAALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL142180 0.85 GAA (0.61) GAAALDH1A1HTTPOLBMAPT
SCHEMBL23105019 0.83 HSD17B10 (0.44) GAAALDH1A1HTTPOLBMAPT
Hydrochloric Acid SCHEMBL11699100 0.82 GAA (0.58) GAAALDH1A1HTTPOLBMAPT
SCHEMBL17092622 0.82 GAA (0.56) GAAALDH1A1HTTPOLBMAPT
SCHEMBL10109058 0.81 MEN1 (0.47) GAAALDH1A1MAPTSMN1; SMN2TDP1

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-1505872-A1 RODENTICIDAL BAIT SYSTEM Bayer CropScience Aktiengesellschaft (DE) 2005-02-16 EP disclosed
WO-2003094612-A1 RODENTICIDAL BAIT SYSTEM BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-11-20 WO disclosed