SCHEMBL11241260

SCHEMBL11241260

CCC(=O)OC(c1cccnc1)C(Cl)(Cl)Cl

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 2/20 0.40
KCNA5 P22460 4/20 0.39
MAPT P10636 1/20 0.39
CYP19A1 P11511 3/20 0.39
CYP17A1 P05093 2/20 0.39
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
ITGB3 P05106 1/20 0.38
ITGAV P06756 1/20 0.38
FDPS P14324 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
SCHEMBL11236544 0.86 KCNA5 (0.43) LMNASMN1; SMN2L3MBTL1ALDH1A1KCNA5
SCHEMBL11228700 0.84 ALDH1A1 (0.45) LMNASMN1; SMN2L3MBTL1ALDH1A1CYP19A1
SCHEMBL31112942 0.84 SMN1; SMN2 (0.46) LMNASMN1; SMN2L3MBTL1ALDH1A1KCNA5
SCHEMBL11242002 0.83 ALDH1A1 (0.40) LMNASMN1; SMN2L3MBTL1ALDH1A1KCNA5
SCHEMBL16908660 0.82 HTT (0.44) LMNASMN1; SMN2ALDH1A1GAAHTT
SCHEMBL11244521 0.81 POLB (0.39) ALDH1A1KCNA5CYP19A1CYP17A1GAA
SCHEMBL29790249 0.78 SMN1; SMN2 (0.46) LMNASMN1; SMN2L3MBTL1ALDH1A1KCNA5
SCHEMBL11248372 0.78 PLOD2 (0.44) LMNASMN1; SMN2ALDH1A1MAPTGAA
SCHEMBL11235465 0.76 GAA (0.47) LMNASMN1; SMN2L3MBTL1ALDH1A1MAPT
SCHEMBL7602372 0.76 ALDH1A1 (0.49) LMNASMN1; SMN2L3MBTL1ALDH1A1KCNA5

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
US-4339455-A 1-(3-Pyridyl)-2,2,2-trihaloethyl compounds and fungicidal compositions containing the same CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1982-07-13 US disclosed
US-4189486-A FUNGICIDES CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1980-02-19 US disclosed