SCHEMBL15846995

SCHEMBL15846995

Cn1cc(C(=O)CC(=O)C(F)(F)F)cn1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PLOD2 O00469 3/20 0.50
▸ PLOD3 O60568 2/20 0.50
▸ PLOD1 Q02809 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ LMNA P02545 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ GRN P28799 1/20 0.43
▸ SORT1 Q99523 1/20 0.43
▸ ACHE P22303 8/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ GSK3B P49841 1/20 0.38
▸ DYRK1A Q13627 1/20 0.38
▸ VNN1 O95497 1/20 0.37

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
SCHEMBL13306661 0.80 SMN1; SMN2 (0.44) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL12221241 0.78 ACHE (0.58) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL31567734 0.78 ACHE (0.62) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL27229134 0.77 SMN1; SMN2 (0.46) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL12221255 0.75 SMN1; SMN2 (0.45) SMN1; SMN2LMNAHPGDGRNSORT1
Trifluoroacetic Acid SCHEMBL31612730 0.75 MKNK1 (0.48) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL17570796 0.75 SMN1; SMN2 (0.46) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL5267198 0.74 SMN1; SMN2 (0.43) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL24340341 0.74 SMN1; SMN2 (0.44) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL17801296 0.74 ALDH1A1 (0.53) SMN1; SMN2LMNAHPGDGRNSORT1

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
WO-2014104917-A1 RARE EARTH METAL ION COMPLEX, LUMINESCENT COMPOSITE MATERIAL, LIGHT EMITTING DEVICE, AND USE ORGANIC LIGHTING SOLUTIONS UG (DE) 2014-07-03 — — WO disclosed
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