SCHEMBL17836748

SCHEMBL17836748

Fc1cccc(F)c1-c1nc(N/N=C/c2ccc(OC(F)(F)F)cc2)nc(Nc2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.49
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MITF O75030 1/20 0.47
GAA P10253 1/20 0.47
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
IDH2 P48735 4/20 0.45
HTT P42858 2/20 0.45
POLB P06746 1/20 0.45
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
ENPP2 Q13822 1/20 0.43
APP P05067 3/20 0.43

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
SCHEMBL415830 1.00 LRRK2 (0.49) LRRK2NPC1RAB9AMEN1KMT2A
SCHEMBL415720 1.00 LRRK2 (0.49) LRRK2NPC1RAB9AMEN1KMT2A
SCHEMBL10241983 0.90 DDX3X (0.48) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL415846 0.90 DDX3X (0.48) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL415825 0.90 DDX3X (0.48) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL416612 0.88 MEN1 (0.44) LRRK2NPC1RAB9AMEN1KMT2A
SCHEMBL417463 0.88 MEN1 (0.44) LRRK2NPC1RAB9AMEN1KMT2A
SCHEMBL10242562 0.88 MEN1 (0.44) LRRK2NPC1RAB9AMEN1KMT2A
SCHEMBL414775 0.85 CHRNA7 (0.51) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL10242560 0.85 CHRNA7 (0.51) NPC1RAB9AMEN1KMT2AMITF

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