SCHEMBL8745843

SCHEMBL8745843

NN=C(c1ccc(Cl)cc1)c1ccc(OC(F)(F)Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.43
PPARA Q07869 4/20 0.39
PPARG P37231 2/20 0.39
FABP2 P12104 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
PSEN1 P49768 3/20 0.39
PSEN2 P49810 3/20 0.39
APH1B Q8WW43 3/20 0.39
NCSTN Q92542 3/20 0.39
APH1A Q96BI3 3/20 0.39
PSENEN Q9NZ42 3/20 0.39
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C19 P33261 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP2D6 P10635 1/20 0.37
MGLL Q99685 1/20 0.36
NPSR1 Q6W5P4 3/20 0.35

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
SCHEMBL9324441 0.80 PPARA (0.45) PPARAPPARGFABP2SLC22A12MAPT
SCHEMBL17338765 0.79 GRIN2B (0.51) GRIN2BMAPT
SCHEMBL6181273 0.78 ESR1 (0.48) GRIN2BMAPTCYP3A4CYP2C19CYP2D6
SCHEMBL8533900 0.78 CA1 (0.46) PPARAPPARGFABP2SLC22A12PSEN1
SCHEMBL7108334 0.78 CA1 (0.46) PPARAPPARGFABP2SLC22A12PSEN1
SCHEMBL8745850 0.78 PPARA (0.61) PPARAPPARGFABP2SLC22A12MAPT
SCHEMBL17338837 0.76 HPGD (0.59) MAPTMEN1CYP2C19KMT2ANPSR1
SCHEMBL8745833 0.76 PPARA (0.42) PPARAPPARGFABP2SLC22A12PSEN1
SCHEMBL17338831 0.71 GRIN2B (0.44) GRIN2BMAPTMAPK1
SCHEMBL17338830 0.71 GRIN2B (0.44) GRIN2BMAPTMAPK1

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-0757671-A1 PERHALOALKOXYBENZENOPHENONE HYDRAZONES AND THEIR USE AS PESTICIDES Novartis AG (CH) 1997-02-12 EP disclosed
WO-1995029889-A1 PERHALOALKOXYBENZENOPHENONE HYDRAZONES AND THEIR USE AS PESTICIDES CIBA-GEIGY AG (CH) 1995-11-09 WO disclosed