SCHEMBL11001290

SCHEMBL11001290

COC(=O)C(C(=O)OC)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 9/20 0.59
SLC6A2 P23975 2/20 0.55
SLC6A4 P31645 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL1783131 0.89 SLC6A3 (0.52) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL14739506 0.86 SLC6A3 (0.50) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL14739505 0.86 SLC6A3 (0.50) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL28181867 0.86 SLC6A3 (0.56) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL7680719 0.84 MEN1 (0.45) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL1566492 0.84 SLC6A3 (0.57) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL1626214 0.84 SLC6A3 (0.57) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL1566494 0.84 SLC6A3 (0.57) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL5487986 0.84 SLC6A3 (0.57) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1
SCHEMBL9395161 0.82 SLC6A3 (0.56) SLC6A3SLC6A2SLC6A4SMN1; SMN2ALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4562185-A INSECTICIDES; MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 1985-12-31 US disclosed