SCHEMBL1809772

SCHEMBL1809772

Nc1ncccc1-c1nn[nH]c1Cc1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.48
PARP10 Q53GL7 1/20 0.42
MAOA P21397 2/20 0.41
KDM1A O60341 1/20 0.41
SCN9A Q15858 1/20 0.40
IGF1R P08069 1/20 0.40
NR4A2 P43354 1/20 0.40

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
SCHEMBL1809286 0.89 IGF1R (0.40) MAOBMAOAIGF1R
SCHEMBL1805275 0.80 NPC1 (0.48)
SCHEMBL624562 0.79 MAOB (0.62) MAOBPARP10NR4A2
SCHEMBL1809893 0.79 LMNA (0.44)
SCHEMBL511003 0.75 MAOB (0.49) MAOBPARP10MAOAKDM1ASCN9A
SCHEMBL30025809 0.75 MAOB (0.49) MAOBPARP10MAOAKDM1ASCN9A
SCHEMBL1809770 0.72 MAOB (0.48) MAOBPARP10MAOA
SCHEMBL7004436 0.72 MAOB (0.59) MAOBPARP10MAOASCN9ANR4A2
SCHEMBL1680671 0.69 MAOB (0.54) MAOBPARP10MAOASCN9ANR4A2
SCHEMBL7009322 0.68 MAOB (0.56) MAOBPARP10MAOASCN9ANR4A2

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-2011051198-A2 PYRIDINE DERIVATIVES AS AGRICULTURAL PESTICIDES BAYER CROPSCIENCE AG (DE) 2011-05-05 WO claimed