SCHEMBL5583583

SCHEMBL5583583

COc1ccnc(C(=O)NCCC(C)(C)C)c1O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.44
PDE10A Q9Y233 1/20 0.41
EGLN2 Q96KS0 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 1/20 0.38
HSD17B13 Q7Z5P4 1/20 0.37
GSK3B P49841 3/20 0.37
EGLN1 Q9GZT9 2/20 0.37
NPC1 O15118 1/20 0.36
HSP90AA1 P07900 1/20 0.36
BACE1 P56817 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
ANO1 Q5XXA6 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL14307432 0.84 ALDH1A1 (0.41) KMT2AMEN1MAPTGSK3BEGLN1
SCHEMBL5583874 0.81 NAAA (0.50)
SCHEMBL5583619 0.81 NAAA (0.50)
SCHEMBL5583825 0.81 NAAA (0.50)
SCHEMBL5583726 0.79 PDGFRA (0.50) KMT2AMEN1NPC1HPGD
SCHEMBL5583778 0.79 POLB (0.44) EGLN2EGLN1ANO1
SCHEMBL5583623 0.78 RAB9A (0.50) KMT2AMEN1MAPTNPC1MTNR1A
SCHEMBL2486939 0.78 EPHX2 (0.53) KMT2AMEN1MAPTMTNR1AMTNR1B
SCHEMBL14284458 0.77 EGLN1 (0.41) KMT2AMEN1MAPTEGLN1NPC1
SCHEMBL5583644 0.77 RAB9A (0.52) MLYCDKMT2AMEN1HPGD

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
US-7183278-B1 Picolinamide derivative and harmful organism control agent comprising said picolinamide derivative as active component MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-27 US disclosed
EP-1134214-A1 PICOLINAMIDE DERIVATIVES AND PEST CONTROLLERS CONTAINING THE SAME AS THE ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2001-09-19 EP disclosed