SCHEMBL20708733

SCHEMBL20708733

CC(C)(C)C(=O)Nc1ccc(CC(F)(F)F)nc1Cl

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDK1 Q15118 18/20 0.45
▸ PDK2 Q15119 18/20 0.45
▸ PDK3 Q15120 18/20 0.45
▸ PDK4 Q16654 18/20 0.45
▸ KDM4E B2RXH2 1/20 0.40
▸ MITF O75030 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ KLF5 Q13887 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL9952130 0.79 CYP1A2 (0.43) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL15426481 0.77 L3MBTL1 (0.44) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL14782288 0.74 L3MBTL1 (0.41) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL28210638 0.68 SMN1; SMN2 (0.58) ALDH1A1SMN1; SMN2
SCHEMBL23628484 0.68 L3MBTL1 (0.41) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL25219070 0.68 L3MBTL1 (0.41) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL31718129 0.67 PDK1 (0.69) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL14254880 0.67 PDK1 (0.69) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL23628496 0.67 L3MBTL1 (0.43) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL6568163 0.67 PDK1 (0.71) PDK1PDK2PDK3PDK4

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
EP-3006429-B1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL CO (JP) 2019-02-06 — — EP disclosed
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