SCHEMBL308654

SCHEMBL308654

O=[N+]([O-])c1cc[n+]([O-])c(-c2ccccn2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
NPC1 O15118 5/20 0.47
RAB9A P51151 5/20 0.47
KDM4E B2RXH2 4/20 0.47
METAP1 P53582 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GPR35 Q9HC97 1/20 0.46
GRM5 P41594 1/20 0.45
ABL1 P00519 1/20 0.44
BCR P11274 1/20 0.44
PRKCA P17252 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.41
CYP19A1 P11511 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
PDE7A Q13946 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL5026994 0.95 MAPT (0.43) MAPTNPC1RAB9AKDM4EMETAP1
SCHEMBL2227750 0.79 TSHR (0.48) MAPTGPR35ALDH1A1CYP19A1CYP3A4
SCHEMBL21624988 0.77 NPC1 (0.39) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL308655 0.76 TSHR (0.44) MAPTL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL9598969 0.75 KDM4E (0.42) MAPTNPC1RAB9AKDM4EMETAP1
SCHEMBL308765 0.75 KDM4E (0.42) MAPTNPC1RAB9AKDM4EMETAP1
SCHEMBL29851568 0.74 ABL1 (0.57) MAPTNPC1RAB9AKDM4EMETAP1
SCHEMBL7032457 0.74 ABL1 (0.57) MAPTNPC1RAB9AKDM4EMETAP1
SCHEMBL30305663 0.72 KDM4E (0.50) MAPTNPC1RAB9AKDM4EMETAP1
SCHEMBL1367753 0.72 KDM4E (0.50) MAPTNPC1RAB9AKDM4EMETAP1

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10219730-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2019-03-05 US disclosed
US-20160296147-A1 Redox Polymers THERASENSE, INC. 2016-10-13 US disclosed
EP-2643299-B1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS NOSCIRA SA (ES) 2016-06-22 EP disclosed
EP-2643299-B1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS NOSCIRA SA (ES) 2016-06-22 EP disclosed
US-9320467-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2016-04-26 US disclosed
US-9324504-B2 Organic metal dye, and photoelectric element and dye-sensitized solar cell using the organic metal dye SFC CO., LTD. (KR) 2016-04-26 US disclosed
US-9284296-B2 Bipyridine sulfonamide derivatives for the treatment of neurodegenerative diseases or conditions AUBERGINE PHARMACEUTICALS LLC (US) 2016-03-15 US disclosed
US-9284296-B2 Bipyridine sulfonamide derivatives for the treatment of neurodegenerative diseases or conditions AUBERGINE PHARMACEUTICALS LLC (US) 2016-03-15 US disclosed
US-20140364710-A1 Redox Polymers THERASENSE, INC. 2014-12-11 US disclosed
US-8828204-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2014-09-09 US disclosed
US-20080275088-A1 Use of Collismycin and Derivatives Thereof as Oxidative Stress Inhibitors NEUROPHARMA, S.A. (ES) 2008-11-06 US disclosed
EP-1230248-B1 TRANSITION METAL COMPLEXES ATTACHED TO A POLYMER VIA A FLEXIBLE CHAIN THERASENSE INC (US) 2007-06-06 EP disclosed
US-6605200-B1 Charge transfer compounds comprising polymers such as polyvinylpyridine and/or copolymers coupled to osmium compounds, used as biosensors in redox systems THERASENSE, INC. 2003-08-12 US disclosed
EP-1230248-A2 TRANSITION METAL COMPLEXES ATTACHED TO A POLYMER VIA A FLEXIBLE CHAIN Therasense, Inc. (US) 2002-08-14 EP disclosed
WO-2001036660-A2 TRANSITION METAL COMPLEXES ATTACHED TO A POLYMER VIA A FLEXIBLE CHAIN THERASENSE, INC. (US) 2001-05-25 WO disclosed
EP-0243450-B1 PYRIDINYLUREA COMPOUNDS AND AGRICULTURAL USES FMC Corporation (US) 1993-04-28 EP disclosed
EP-0243450-A4 PYRIDINYLUREA COMPOUNDS AND AGRICULTURAL USES. FMC CORP (US) 1989-09-11 EP disclosed
US-4808722-A PLANT GROWTH REGULATORS FMC CORPORATION (US) 1989-02-28 US disclosed
EP-0243450-A1 PYRIDINYLUREA COMPOUNDS AND AGRICULTURAL USES. FMC CORP (US) 1987-11-04 EP disclosed
WO-1987002665-A1 PYRIDINYLUREA COMPOUNDS AND AGRICULTURAL USES FMC CORPORATION (US) 1987-05-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080275088-A1 Use of Collismycin and Derivatives Thereof as Oxidative Stress Inhibitors PARK7, HSPA9, NLN MAPT 123/4885NPC1 311/4885RAB9A 1201/4885
US-10219730-B2 Redox polymers PPOX, OTC, ME3 MAPT 3737/4885NPC1 4855/4885RAB9A 4017/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.