SCHEMBL15775217

SCHEMBL15775217

NNC(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.57
GAA P10253 2/20 0.56
KMT2A Q03164 3/20 0.55
PKM P14618 1/20 0.55
BCL9 O00512 1/20 0.53
CTNNB1 P35222 1/20 0.53
MAPT P10636 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
MAPK1 P28482 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MYOC Q99972 1/20 0.50
HGFAC Q04756 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 1/20 0.47
CES2 O00748 1/20 0.47

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
Hydrochloric Acid SCHEMBL27724857 0.98 MGLL (0.56) MGLLGAAKMT2APKMBCL9
SCHEMBL27909645 0.91 MGLL (0.53) MGLLGAAKMT2APKMBCL9
SCHEMBL28859982 0.85 KMT2A (0.49) MGLLGAAKMT2APKMBCL9
SCHEMBL16588595 0.85 MGLL (0.60) MGLLGAAKMT2APKMBCL9
SCHEMBL17373926 0.85 MGLL (0.60) MGLLGAAKMT2APKMBCL9
SCHEMBL3762920 0.84 MGLL (0.59) MGLLGAAKMT2APKMBCL9
SCHEMBL28200212 0.83 GAA (0.53) MGLLGAAKMT2APKMBCL9
SCHEMBL11416881 0.83 MGLL (0.55) MGLLGAAKMT2APKMBCL9
SCHEMBL2147924 0.83 MGLL (0.58) MGLLGAAKMT2APKMBCL9
SCHEMBL13137639 0.82 MGLL (0.57) MGLLGAAKMT2APKMBCL9

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-103491982-B The polynucleotides delivering in vivo conjugate connected with enzyme sensitiveness 箭头研究公司 2017-09-12 CN disclosed
WO-2014086478-A1 INHIBITORS OF MALT1 PROTEASE Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) 2014-06-12 WO disclosed
WO-2014086478-A1 INHIBITORS OF MALT1 PROTEASE Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) 2014-06-12 WO disclosed
CN-102224139-A Novel 4- (azacycloalkyl) benzene-1, 3-diol compounds as tyrosinase inhibitors, process for their preparation and their use in human medicine and cosmetics GALDERMA RES & DEV 2011-10-19 CN disclosed