SCHEMBL27794659

SCHEMBL27794659

O=C(NNc1ccccc1)c1ccc(/N=N/c2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.70
F2 P00734 1/20 0.62
ALDH1A1 P00352 5/20 0.59
GAA P10253 4/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
KDM4E B2RXH2 3/20 0.59
TRPA1 O75762 1/20 0.56
MAPT P10636 6/20 0.53
RAB9A P51151 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
MAPK1 P28482 2/20 0.51
HPGD P15428 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
HIF1A Q16665 1/20 0.51
GFER P55789 2/20 0.51
MEN1 O00255 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
SCHEMBL425101 0.83 PTGS2 (1.00) PTGS2ALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL17472006 0.82 PTPN1 (0.67) SMN1; SMN2KDM4ETRPA1MAPTRAB9A
SCHEMBL20194015 0.82 PTPN1 (0.67) SMN1; SMN2KDM4ETRPA1MAPTRAB9A
SCHEMBL9785877 0.82 PTGS2 (0.81) PTGS2ALDH1A1GAASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL9017504 0.81 PTGS2 (0.96) PTGS2ALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL29571672 0.79 PTGS2 (0.70) PTGS2ALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL28929580 0.79 F2 (0.61) PTGS2F2ALDH1A1GAASMN1; SMN2
SCHEMBL31156728 0.79 F2 (0.61) PTGS2F2ALDH1A1GAASMN1; SMN2
SCHEMBL9829474 0.79 PTGS2 (0.75) PTGS2ALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL4897180 0.79 PTGS2 (0.75) PTGS2ALDH1A1GAASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114487219-A Extracting agent and extracting method for detecting harmful substances in coating 中国石油化工股份有限公司 2022-05-13 CN disclosed
CN-206725447-U Cr VI on-line computing model in a kind of water 马鞍山市桓泰环保设备有限公司 2017-12-08 CN disclosed
CN-206684036-U A kind of water quality on-line monitoring instrument 马鞍山市桓泰环保设备有限公司 2017-11-28 CN disclosed
CN-203981691-U Sexavalent chrome online auto monitoring device SHANDONG SIRUI ENVIRONMENTAL EQUIPMENT TECHNOLOGY CO LTD 2014-12-03 CN disclosed
CN-102004083-B Water quality analyzer for analyzing parameters of copper, chromium and nickel NANTONG HUIHUAN ENVIRONMENTAL PROT TECHNOLOGY CO LTD 2012-10-17 CN disclosed
CN-201885968-U Water quality analyzer for parameters of copper, chromium and nickel NANTONG HUIHUAN ENVIRONMENTAL PROT TECHNOLOGY CO LTD 2011-06-29 CN disclosed
CN-102004083-A Water quality analyzer for analyzing parameters of copper, chromium and nickel NANTONG HUIHUAN ENVIRONMENTAL PROT TECHNOLOGY CO LTD 2011-04-06 CN disclosed
CN-201561931-U Automatic online hexavalent chromium monitoring device SANJIAN MA 2010-08-25 CN disclosed