SCHEMBL12779147

SCHEMBL12779147

CCO/N=C(\C)c1cc(Cl)ccc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
TMPRSS4 Q9NRS4 4/20 0.36
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
THRB P10828 1/20 0.35
GAA P10253 2/20 0.35
POLQ O75417 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
AKR1B10 O60218 1/20 0.34
AKR1C4 P17516 1/20 0.34
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
AKR1C1 Q04828 1/20 0.34
TRPA1 O75762 1/20 0.34
NPFFR2 Q9Y5X5 1/20 0.34
ANO1 Q5XXA6 1/20 0.34

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
SCHEMBL12779780 0.90 HTT (0.39) HTTTMPRSS4MAPTL3MBTL1TDP1
SCHEMBL12779769 0.88 GAA (0.42) HTTTMPRSS4MAPTL3MBTL1TDP1
SCHEMBL12779777 0.86 HTT (0.42) HTTTMPRSS4MAPTL3MBTL1TDP1
SCHEMBL12779102 0.86 MAPT (0.49) HTTMAPTL3MBTL1TDP1GAA
SCHEMBL12779742 0.86 HTT (0.37) HTTTMPRSS4MAPTL3MBTL1TDP1
SCHEMBL12779600 0.86 HTT (0.37) HTTTMPRSS4MAPTL3MBTL1TDP1
SCHEMBL12779821 0.85 HTT (0.36) HTTTMPRSS4MAPTL3MBTL1TDP1
SCHEMBL12779707 0.85 MAPT (0.42) HTTTMPRSS4MAPTL3MBTL1TDP1
SCHEMBL12779146 0.85 HTT (0.42) HTTTMPRSS4MAPTGAAMEN1
SCHEMBL12779219 0.84 CCR5 (0.33) HTTMAPTL3MBTL1PTGDR2MEN1

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
US-7906538-B2 Parasiticides; nematocides; crop protection SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2011-03-15 US disclosed