SCHEMBL17836751

SCHEMBL17836751

FC(F)(F)Oc1ccc(/C=N/Nc2nc(NCc3ccc(Cl)cc3)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.51
GPR39 O43194 4/20 0.51
HTT P42858 3/20 0.51
LMNA P02545 5/20 0.48
MAPK1 P28482 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
VCP P55072 1/20 0.44
BRD4 O60885 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
NPSR1 Q6W5P4 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
BACE1 P56817 1/20 0.41

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
SCHEMBL416423 1.00 MAPT (0.51) MAPTGPR39HTTLMNAMAPK1
SCHEMBL415522 1.00 MAPT (0.51) MAPTGPR39HTTLMNAMAPK1
SCHEMBL10240829 0.90 GPR39 (0.48) MAPTGPR39HTTLMNAMAPK1
SCHEMBL413714 0.90 GPR39 (0.48) MAPTGPR39HTTLMNAMAPK1
SCHEMBL413715 0.90 GPR39 (0.48) MAPTGPR39HTTLMNAMAPK1
SCHEMBL459932 0.89 MAPT (0.43) MAPTGPR39HTTLMNAMAPK1
SCHEMBL17836754 0.89 MAPT (0.43) MAPTGPR39HTTLMNAMAPK1
SCHEMBL10240830 0.86 MAPT (0.50) MAPTHTTLMNAMAPK1MEN1
SCHEMBL418073 0.86 MAPT (0.50) MAPTHTTLMNAMAPK1MEN1
SCHEMBL415579 0.86 MAPT (0.50) MAPTHTTLMNAMAPK1MEN1

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-2595965-B1 INSECTICIDAL TRIAZINES AND PYRIMIDINES VESTARON CORP (US) 2016-06-22 EP disclosed