SCHEMBL7972200

SCHEMBL7972200

FC(F)(F)c1ccc(-c2[c]cc(Cl)cn2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.40
DYRK1A Q13627 1/20 0.39
DYRK2 Q92630 1/20 0.39
CYP19A1 P11511 1/20 0.37
SCN2A Q99250 2/20 0.36
TRPV1 Q8NER1 1/20 0.35
COMT P21964 1/20 0.35
CASP3 P42574 1/20 0.35
AHR P35869 1/20 0.34
NOTUM Q6P988 1/20 0.34
ALOX5 P09917 1/20 0.34
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
KDM1A O60341 1/20 0.33
MAOB P27338 1/20 0.33
ATF1 P18846 1/20 0.33
NFKB1 P19838 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
SCHEMBL7972131 0.81 SCN2A (0.44) DYRK1ADYRK2SCN2ANOTUMKDM1A
SCHEMBL7969223 0.80 SCN10A (0.39) SCN2ANOTUMALOX5
SCHEMBL7972246 0.77 CYP1A2 (0.38) SCN2ANFKB1
SCHEMBL7958295 0.71 HSD11B1 (0.39) TRPV1NOTUM
SCHEMBL5544984 0.69 KIF11 (0.47) KIF11SCN2ATRPV1
SCHEMBL1740256 0.67 KIF11 (0.54) KIF11DYRK1ADYRK2CYP19A1SCN2A
SCHEMBL8876935 0.67 KIF11 (0.61) KIF11CYP19A1AHRALOX5MAOB
SCHEMBL1744141 0.66 KIF11 (0.52) KIF11DYRK1ADYRK2SCN2ANOTUM
SCHEMBL15063925 0.66 KIF11 (0.48) KIF11AHRMAOB
SCHEMBL3322318 0.65 KIF11 (0.50) KIF11DYRK1ADYRK2TRPV1S1PR1

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
WO-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO disclosed