SCHEMBL3847246

SCHEMBL3847246

Cc1nnc(Cl)c(-c2c(F)cccc2F)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
HPGD P15428 2/20 0.40
PDE2A O00408 2/20 0.37
PDE10A Q9Y233 2/20 0.37
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
ESR1 P03372 1/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ELANE P08246 1/20 0.33
NPC1 O15118 1/20 0.33
CASP3 P42574 1/20 0.33
RAB9A P51151 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
ACHE P22303 1/20 0.31

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
SCHEMBL3843013 0.91 PDE2A (0.43) KMT2AHPGDPDE2APDE10ALMNA
SCHEMBL28028926 0.89 PDE2A (0.38) KMT2AHPGDPDE2APDE10ALMNA
SCHEMBL3851086 0.82 KMT2A (0.38) KMT2AHPGDPDE2APDE10ALMNA
SCHEMBL10015953 0.80 MAOB (0.42) KMT2AHPGDPDE2APDE10ALMNA
SCHEMBL29369509 0.78 NPC1 (0.44) KMT2AHPGDPDE2APDE10AMEN1
SCHEMBL69222 0.78 NPC1 (0.44) KMT2AHPGDPDE2APDE10AMEN1
SCHEMBL2888290 0.77 NPC1 (0.43) KMT2AHPGDPDE2APDE10AMEN1
SCHEMBL3861650 0.75 PDE2A (0.41) KMT2AHPGDPDE2APDE10ALMNA
SCHEMBL1162344 0.74 ALDH1A1 (0.41) KMT2AHPGDPDE2APDE10ALMNA
SCHEMBL3851796 0.74 RXFP1 (0.37) KMT2AHPGDPDE2APDE10ALMNA

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-2042491-A1 Pyridazines as fungicides Bayer CropScience AG (DE) 2009-04-01 EP disclosed