SCHEMBL5583697

SCHEMBL5583697

CCOc1ccc(ONc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.57
NQO1 P15559 1/20 0.54
GAA P10253 1/20 0.53
RELA Q04206 1/20 0.52
NPC1 O15118 5/20 0.49
RAB9A P51151 4/20 0.49
ADRA2A P08913 1/20 0.49
KMT2A Q03164 5/20 0.49
MAPT P10636 4/20 0.49
MEN1 O00255 4/20 0.49
L3MBTL1 Q9Y468 3/20 0.47
HPGD P15428 3/20 0.47
KDM4E B2RXH2 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
POLB P06746 2/20 0.47
OPRM1 P35372 1/20 0.47
OPRD1 P41143 1/20 0.47
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SLC2A1 P11166 1/20 0.46

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
SCHEMBL19411968 0.83 ALDH1A1 (0.43) LTA4HGAANPC1RAB9AKMT2A
SCHEMBL9479637 0.80 MAPT (0.63) LTA4HNQO1GAARELANPC1
SCHEMBL3440767 0.80 MAPT (0.63) LTA4HNQO1GAARELANPC1
SCHEMBL5583614 0.80 ALOX15 (0.60) NQO1GAANPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL8021451 0.80 MAOB (0.49) GAARELANPC1RAB9AKMT2A
SCHEMBL251644 0.79 ALDH1A1 (0.43) LTA4HKMT2AMAPTMEN1L3MBTL1
SCHEMBL6510351 0.78 HPGD (0.52) GAANPC1RAB9AKMT2AMAPT
SCHEMBL8590182 0.78 CA4 (0.54) LTA4HGAANPC1RAB9AKMT2A
SCHEMBL29448429 0.77 CYP1A2 (0.38) GAAMAPTL3MBTL1TDP1ALDH1A1
SCHEMBL29288587 0.77 LTA4H (0.50) LTA4HKMT2AMAPTMEN1HPGD

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