SCHEMBL17698486

SCHEMBL17698486

Cc1nn(C)c(Nc2c(F)cccc2Br)c1-c1ccc(F)cc1Cl.Cc1nn(C)c(Nc2c(F)cccc2Cl)c1-c1ccc(F)cc1Br

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.37
SLC34A1 Q06495 3/20 0.33
IGF1R P08069 2/20 0.32
CXCR2 P25025 1/20 0.31
P2RX7 Q99572 2/20 0.31
MAPT P10636 2/20 0.31
ABCB11 O95342 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
PPARG P37231 1/20 0.31
NR1I3 Q14994 1/20 0.31
GRM4 Q14833 1/20 0.31
LMNA P02545 1/20 0.30
KDM4E B2RXH2 1/20 0.30
GALR3 O60755 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL29355021 0.94 HSD11B1 (0.36) HSD11B1SLC34A1P2RX7MAPTABCB11
SCHEMBL171531 0.94 HSD11B1 (0.36) HSD11B1SLC34A1P2RX7MAPTABCB11
SCHEMBL29368758 0.94 HSD11B1 (0.39) HSD11B1SLC34A1IGF1RCXCR2P2RX7
SCHEMBL173254 0.94 HSD11B1 (0.39) HSD11B1SLC34A1IGF1RCXCR2P2RX7
SCHEMBL29369400 0.91 HSD11B1 (0.43) HSD11B1SLC34A1IGF1RP2RX7MAPT
SCHEMBL29367616 0.91 MAPT (0.35) SLC34A1CXCR2MAPTKDM4EGALR3
SCHEMBL14956153 0.91 MAPT (0.35) SLC34A1CXCR2MAPTKDM4EGALR3
SCHEMBL170786 0.91 HSD11B1 (0.43) HSD11B1SLC34A1IGF1RP2RX7MAPT
SCHEMBL15155523 0.87 MAPT (0.36) SLC34A1MAPTKDM4EGALR3HTT
SCHEMBL29367611 0.87 HSD11B1 (0.42) HSD11B1SLC34A1IGF1RP2RX7MAPT

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-3011832-A1 FUNGICIDAL COMBINATION COMPRISING PHENOXYPHENYLAMIDINES AND FURTHER FUNGICIDE Bayer CropScience AG (DE) 2016-04-27 EP disclosed