SCHEMBL1015607

SCHEMBL1015607

O=[N+]([O-])c1cccc(-c2cn[nH]c2)c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.61
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 3/20 0.51
MAPT P10636 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
PDE4B Q07343 2/20 0.51
PDE4D Q08499 1/20 0.51
PGR P06401 3/20 0.50
TSHR P16473 1/20 0.50
AKT1 P31749 1/20 0.50
AKT2 P31751 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 1/20 0.48
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47
CYP1A2 P05177 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 SCHEMBL1013817 0.98 IDO1 (0.60) IDO1TDP1LMNAMAPTNPC1
SCHEMBL6738366 0.80 TSHR (0.76) IDO1TDP1LMNAMAPTNPC1
SCHEMBL2018887 0.80 AKT2 (0.52) LMNAMAPTNPC1RAB9AAKT1
Iodide SCHEMBL30804629 0.78 TSHR (0.73) IDO1TDP1LMNAMAPTNPC1
SCHEMBL11392461 0.78 TSHR (0.73) IDO1TDP1LMNAMAPTNPC1
SCHEMBL28471286 0.78 TSHR (0.73) IDO1TDP1LMNAMAPTNPC1
SCHEMBL11392466 0.78 TSHR (0.73) IDO1TDP1LMNAMAPTNPC1
SCHEMBL30424015 0.78 AKT2 (0.71) AKT1AKT2
Iodide SCHEMBL28598177 0.78 TSHR (0.73) IDO1TDP1LMNAMAPTNPC1
SCHEMBL4585369 0.76 IDO1 (0.56) IDO1TDP1LMNAMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3985001-B1 PHARMACEUTICAL COMPOSITION FOR USE IN TREATING A CANCER SERVIER LAB (FR) 2026-04-29 EP disclosed
US-20240059733-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC (US) 2024-02-22 US disclosed
US-11667673-B2 Therapeutically active compounds and their methods of use SERVIER PHARMACEUTICALS LLC (US) 2023-06-06 US disclosed
US-11667673-B2 Therapeutically active compounds and their methods of use SERVIER PHARMACEUTICALS LLC (US) 2023-06-06 US disclosed
EP-3985001-A1 PHARMACEUTICAL COMPOSITION USEFUL IN INHIBITING IDH1 Les Laboratoires Servier SAS (FR) 2022-04-20 EP disclosed
EP-3447052-B1 METHODS OF PREPARING NEW IDH1 INHIBITORS LES LABORATOIRES SERVIER SAS (FR) 2021-10-20 EP disclosed
US-11021515-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2021-06-01 US disclosed
US-20210024575-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2021-01-28 US disclosed
US-20200339626-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2020-10-29 US disclosed
US-10717764-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2020-07-21 US disclosed
CN-102105459-B 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES SRL 2014-09-10 CN disclosed
WO-2014067962-A1 NOVEL HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2014-05-08 WO disclosed
WO-2013107291-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC. (US) 2013-07-25 WO disclosed
WO-2013107291-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC. (US) 2013-07-25 WO disclosed
US-20130190249-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC (US) 2013-07-25 US disclosed
US-20130190249-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC (US) 2013-07-25 US disclosed
US-20130190249-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC (US) 2013-07-25 US disclosed
US-8415479-B2 Inhibitor of plasminogen activator inhibitor-1 RENASCIENCE CO., LTD. (JP) 2013-04-09 US disclosed
US-20110112140-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 RENASCIENCE CO., LTD. (JP) 2011-05-12 US disclosed
EP-2272822-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 Renascience CO., LTD. (JP) 2011-01-12 EP 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 (8 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-20200339626-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE IDH1, IDH3B, IDH3A IDO1 2568/4885TDP1 301/4885LMNA 3349/4885
US-20110112140-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 SERPINE1, SERPINB1, SERPINC1 IDO1 704/4885TDP1 1762/4885LMNA 525/4885
US-11021515-B2 Therapeutically active compounds and their methods of use IDH1, IDH3B, IDH3A IDO1 2568/4885TDP1 301/4885LMNA 3349/4885
US-20210024575-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE IDH1, IDH3B, IDH3A IDO1 2568/4885TDP1 301/4885LMNA 3349/4885
US-20240059733-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE IDH1, IDH3B, IDH3A IDO1 2568/4885TDP1 301/4885LMNA 3349/4885
US-20130190249-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE IDH1, IDH3B, IDH3A IDO1 2766/4885TDP1 368/4885LMNA 1945/4885
US-11667673-B2 Therapeutically active compounds and their methods of use IDH1, IDH3B, IDH3A IDO1 2568/4885TDP1 301/4885LMNA 3349/4885
US-10717764-B2 Therapeutically active compounds and their methods of use IDH1, IDH3B, IDH3A IDO1 2568/4885TDP1 301/4885LMNA 3349/4885

“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.