SCHEMBL20220189

SCHEMBL20220189

Cc1ccc(Cl)c(SCC(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
MAPT P10636 4/20 0.33
HPGD P15428 3/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
ALOX12 P18054 2/20 0.33
TP53 P04637 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 3/20 0.33
POLB P06746 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
USP2 O75604 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL20220014 0.88 PDK1 (0.37) PDK1PDK2PDK3PDK4MAPT
SCHEMBL17811805 0.81 L3MBTL1 (0.41) MAPTHPGDKMT2AMEN1ALOX12
SCHEMBL15823851 0.79 PTPRC (0.38) MAPTTP53LMNAALDH1A1POLB
SCHEMBL15058765 0.79 CYP3A4 (0.42) HPGDGAAALOX15HSD17B10ALDH1A1
SCHEMBL20194050 0.78 LDHA (0.35) PDK2MAPTKMT2AMEN1LMNA
SCHEMBL20220175 0.78 GAA (0.34) KMT2AGAA
SCHEMBL28149572 0.78 LMNA (0.40) HPGDKMT2AMEN1TP53LMNA
SCHEMBL17325396 0.76 GAA (0.42) KMT2AGAA
SCHEMBL23902126 0.76 LMNA (0.42) MAPTHPGDKMT2AMEN1ALOX12
SCHEMBL16976330 0.76 PDK1 (0.37) PDK1PDK2PDK3PDK4MAPT

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-2793578-B1 N-ARYLAMIDINE-SUBSTITUTED TRIFLUOROETHYLSULFIDE DERIVATIVES AS ACARICIDES AND INSECTICIDES BAYER CROPSCIENCE AG (DE) 2018-06-06 EP disclosed