SCHEMBL27622896

SCHEMBL27622896

O=C(ONc1ccccc1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.56
CES2 O00748 1/20 0.56
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HPGD P15428 1/20 0.53
ALOX12 P18054 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
POLB P06746 3/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
MITF O75030 1/20 0.53
TDP1 Q9NUW8 1/20 0.51
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 1/20 0.51
PKM P14618 1/20 0.51
CASP3 P42574 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51

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
SCHEMBL28184775 0.94 KMT2A (0.60) CES1CES2LMNASMN1; SMN2HPGD
SCHEMBL11582158 0.85 KMT2A (0.66) LMNASMN1; SMN2HPGDL3MBTL1KMT2A
SCHEMBL11179084 0.83 MEN1 (0.58) CES1CES2LMNASMN1; SMN2HPGD
SCHEMBL5394754 0.81 KMT2A (0.71) CES1LMNASMN1; SMN2HPGDL3MBTL1
SCHEMBL15058988 0.80 TDP1 (0.58) CES1CES2LMNASMN1; SMN2KMT2A
SCHEMBL27372795 0.80 KMT2A (0.70) CES1CES2SMN1; SMN2L3MBTL1KMT2A
SCHEMBL23071370 0.80 KMT2A (0.60) CES1CES2LMNASMN1; SMN2HPGD
SCHEMBL28520017 0.79 KMT2A (0.69) LMNASMN1; SMN2HPGDL3MBTL1KMT2A
Ammonia Solution, Strong SCHEMBL28083920 0.79 KMT2A (0.69) LMNASMN1; SMN2HPGDL3MBTL1KMT2A
SCHEMBL27984069 0.79 KMT2A (0.69) LMNASMN1; SMN2HPGDL3MBTL1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110892065-A Cleaning method 宝洁公司 2020-03-17 CN disclosed
CN-103209934-B Selenium cyanate/salt or monohydrate selenium dioxide ester/salt is removed from the aqueous solution NOVOZYMES A/S (DK) 2016-01-20 CN disclosed
CN-103209934-A Removal of selenocyanate or selenite from aqueous solutions NOVOZYMES AS 2013-07-17 CN disclosed
CN-1649499-A Methods and compositions for killing spores NOVOZYMES AS (DK) 2005-08-03 CN disclosed