SCHEMBL22443382

SCHEMBL22443382

NC(=O)c1ccccc1C1(C(F)(F)F)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 15/20 0.51
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
METAP2 P50579 1/20 0.39
BCAT2 O15382 1/20 0.38
NPC1 O15118 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
SCHEMBL28236004 0.84 ALDH1A1 (0.45) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL28234906 0.79 PDK2 (0.55) PDK2KDM4EALDH1A1MAPTTSHR
SCHEMBL16463396 0.78 PDK2 (0.42) PDK2MAPT
SCHEMBL25374530 0.77 PDK2 (0.49) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL29660938 0.74 PDK2 (0.41) PDK2KDM4EALDH1A1MAPTTSHR
SCHEMBL19205328 0.74 PDK2 (0.46) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL3840448 0.73 KDM4E (0.45) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL21543374 0.72 PDK2 (0.43) PDK2ALDH1A1MAPT
SCHEMBL16463394 0.70 PDK2 (0.37) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL3451774 0.70 KDM4E (0.42) PDK2KDM4EALDH1A1MAPTHPGD

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-3941915-A1 PESTICIDALLY ACTIVE AZOLE AMIDE COMPOUNDS Syngenta Crop Protection AG (CH) 2022-01-26 EP disclosed
WO-2020188027-A1 PESTICIDALLY ACTIVE AZOLE AMIDE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-09-24 WO disclosed