SCHEMBL6595142

SCHEMBL6595142

O=c1nc(/C=C/c2c(Cl)cccc2Cl)cc(C(F)(F)Cl)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 3/20 0.54
NOD1 Q9Y239 3/20 0.54
RAB9A P51151 6/20 0.50
MAPT P10636 9/20 0.49
ALDH1A1 P00352 8/20 0.49
LMNA P02545 5/20 0.49
HPGD P15428 5/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
HTT P42858 4/20 0.49
HSPA1A P0DMV8 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
PSD A5PKW4 1/20 0.46
KDM4E B2RXH2 11/20 0.44
KMT2A Q03164 8/20 0.41
MEN1 O00255 5/20 0.41
POLB P06746 4/20 0.41
USP2 O75604 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 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
SCHEMBL6595145 1.00 TNF (0.54) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6594838 0.91 TNF (0.65) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6594835 0.91 TNF (0.65) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6594197 0.78 MAPT (0.42) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6594202 0.78 MAPT (0.42) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6591447 0.77 TNF (0.83) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6591446 0.77 TNF (0.83) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6591510 0.77 TNF (0.68) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6591507 0.77 TNF (0.68) TNFNOD1RAB9AMAPTALDH1A1
SCHEMBL6597450 0.76 TNF (0.75) TNFNOD1RAB9AMAPTALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 EP claimed
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 EP disclosed