SCHEMBL11239583

SCHEMBL11239583

FC(F)(F)c1cc(NC(=S)Nc2ccc(Cl)cc2)cc(C(F)(F)F)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.52
KDM4E B2RXH2 4/20 0.52
GAA P10253 4/20 0.52
NPSR1 Q6W5P4 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAOB P27338 1/20 0.51
ALDH1A1 P00352 7/20 0.49
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
IGF1R P08069 1/20 0.48
NOX1 Q9Y5S8 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL11085799 0.86 CDK1 (0.53) MAPTKDM4EGAANPSR1TDP1
SCHEMBL11233780 0.85 MAPT (0.62) MAPTKDM4EGAANPSR1ALDH1A1
SCHEMBL4555022 0.81 MAPT (0.67) MAPTKDM4EGAANPSR1TDP1
SCHEMBL11251035 0.81 MAOA (0.59) MAPTKDM4EGAANPSR1TDP1
SCHEMBL8956455 0.77 MAPT (0.75) MAPTKDM4EGAANPSR1MAOB
SCHEMBL5445907 0.77 MAPT (0.75) MAPTKDM4EGAANPSR1MAOB
SCHEMBL4555515 0.75 LMNA (0.68) MAPTKDM4EGAANPSR1TDP1
SCHEMBL24513146 0.75 ORAI1 (0.59) MAPTKDM4ETDP1SMN1; SMN2LMNA
SCHEMBL3534972 0.73 MAPT (0.58) MAPTKDM4EGAANPSR1TDP1
SCHEMBL18025324 0.73 MAPT (0.56) MAPTKDM4EGAANPSR1TDP1

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-4331669-A Fungicidal pyridyl arylureas, compositions containing them and method of controlling fungi and bacteria DOW CHEMICAL COMPANY LIMITED, ENGLAND (GB) 1982-05-25 US claimed