Benzamidoxime

Benzamidoxime

SCHEMBL27799692

N=C(N)c1ccccc1.NC(=NO)c1ccccc1.NC(=NO)c1ccccc1

nearest known ligand 0.70

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.70
F10 P00742 1/20 0.70
F12 P00748 1/20 0.70
F7 P08709 1/20 0.70
F3 P13726 1/20 0.70
PKM P14618 1/20 0.70
BLM P54132 1/20 0.67
PRSS1 P07477 4/20 0.64
PRSS3 P35030 4/20 0.64
PRSS2 P07478 3/20 0.64
KMT2A Q03164 2/20 0.64
C1S P09871 1/20 0.64
RECQL P46063 1/20 0.64
WDR5 P61964 1/20 0.54
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
CYP2C19 P33261 1/20 0.45
NQO2 P16083 2/20 0.44
GRIN1 Q05586 2/20 0.44

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
Benzamidoxime SCHEMBL102483 0.89 KMT2A (0.58) F2F10F12F7F3
SCHEMBL22872296 0.89 KMT2A (0.58) F2F10F12F7F3
Benzamidoxime SCHEMBL30242 0.89 KMT2A (0.58) F2F10F12F7F3
Benzamidoxime SCHEMBL872652 0.89 KMT2A (0.58) F2F10F12F7F3
Benzamidoxime SCHEMBL4293941 0.86 F2 (0.52) F2F10F12F7F3
Benzamidoxime SCHEMBL27457742 0.86 POLB (0.58) F2F10F12F7F3
Benzamidoxime SCHEMBL9211538 0.86 KMT2A (0.56) F2F10F12F7F3
Benzamidine SCHEMBL23067876 0.83 F2 (1.00) F2F10F12F7F3
Benzamidine SCHEMBL9207 0.83
SCHEMBL18557033 0.83 F2 (1.00) F2F10F12F7F3

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-101951897-B Amidoxim carboxylate and N-hydroxyl guanidine carboxylate are for the preparation of the purposes of prodrug DRITTE PATENTPORTFOLIO BETEILIGUNGSGESELLSCHAFT MBH & CO. KG (DE) 2016-01-20 CN disclosed
CN-101951897-A Use of amidoxime carboxylic acid esters and N-hydroxyguanidine carboxylic acid esters for producing prodrugs DRITTE PATENTPORTFOLIO BETEILI 2011-01-19 CN disclosed