SCHEMBL27543750

SCHEMBL27543750

CC(=O)Oc1nc(Br)cc(N)c1Cl

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 2/20 0.33
CYP3A4 P08684 1/20 0.32
ALOX5 P09917 1/20 0.31
MAPK9 P45984 3/20 0.31
MAPK8 P45983 2/20 0.31
MAPK10 P53779 2/20 0.31
MAPK1 P28482 2/20 0.31
PRKD2 Q9BZL6 2/20 0.31
PRKD3 O94806 1/20 0.31
CSF1R P07333 1/20 0.30
CSNK1D P48730 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
SCHEMBL9939459 0.85 CYP3A4 (0.36) NQO2CYP3A4
SCHEMBL2713537 0.84 NQO2 (0.37) NQO2CYP3A4MAPK9MAPK8MAPK10
SCHEMBL27520501 0.83 NQO2 (0.35) NQO2CYP3A4ALOX5MAPK9MAPK8
SCHEMBL27518896 0.81 NQO2 (0.33) NQO2CYP3A4ALOX5MAPK9MAPK8
SCHEMBL28747896 0.79 MAPK8 (0.36) MAPK9MAPK8
SCHEMBL27543538 0.76 GPR35 (0.38) CYP3A4MAPK1
SCHEMBL27905445 0.75 ALOX5 (0.36) ALOX5MAPK1
SCHEMBL27892960 0.74 ALOX5 (0.31) ALOX5
SCHEMBL27778823 0.72 GSK3B (0.33) ALOX5
SCHEMBL27543527 0.71 KDM4E (0.39) CYP3A4ALOX5

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
CN-1281591-C 4-aminopyridinecarboxylates and their use as herbicides DOW AGROSCIENCES LLC (US) 2006-10-25 CN disclosed
CN-1416419-A 4-aminopyridinecarboxylates and their use as herbicides DOW AGROSCIENCES LLC (US) 2003-05-07 CN disclosed