SCHEMBL16637414

SCHEMBL16637414

CC(C)(O)C(C)(C)OB(O)c1ccc([N+](=O)[O-])nc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CHRNB2 P17787 3/20 0.31
CHRNA4 P43681 3/20 0.31
CHRNB4 P30926 2/20 0.30
CHRNA3 P32297 2/20 0.30

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
SCHEMBL290041 0.80
SCHEMBL1608761 0.79 ALDH1A1 (0.40) POLBCYP2C19
SCHEMBL532324 0.77 KMT2A (0.36)
SCHEMBL15201656 0.76 TRPV4 (0.39) CHRNB2CHRNA4
SCHEMBL583753 0.76 DGAT1 (0.33) POLB
SCHEMBL2346145 0.76 CYP3A4 (0.30) CYP2C19
SCHEMBL395314 0.76 KDM4E (0.36) SMN1; SMN2
SCHEMBL18579546 0.75 KCNJ1 (0.30)
SCHEMBL1502522 0.74 NNMT (0.37) MAPTRAB9A
SCHEMBL25223257 0.74 MAPT (0.44) MAPTRAB9APOLBSMN1; SMN2CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109689653-B For the preparation of 2- (6-nitropyridin-3-yl) -9H-bipyridino [2, 3-b; process for 3 ', 4' -d ] pyrroles 豪夫迈·罗氏有限公司 2022-04-12 CN claimed
EP-3510031-B1 PROCESS FOR PREPARATION OF 2-(6-NITROPYRIDIN-3-YL)-9H-DIPYRIDO[2,3-B;3',4'-D]PYRROLE HOFFMANN LA ROCHE (CH) 2020-12-02 EP claimed
US-20190300529-A1 Process for preparation of 2-(6-nitropyridin-3-yl)-9H-dipyrido[2,3-b;3',4'-d]pyrrole HOFFMANN-LA ROCHE INC. (US) 2019-10-03 US claimed
EP-3510031-A1 PROCESS FOR PREPARATION OF 2-(6-NITROPYRIDIN-3-YL)-9H-DIPYRIDO[2,3-B;3',4'-D]PYRROLE H. Hoffnabb-La Roche Ag (CH) 2019-07-17 EP claimed
WO-2018046428-A1 PROCESS FOR PREPARATION OF 2-(6-NITROPYRIDIN-3-YL)-9H-DIPYRIDO[2,3-B;3',4'-D]PYRROLE F. HOFFMANN-LA ROCHE AG (CH) 2018-03-15 WO claimed
WO-2025098545-A1 NUCLEOSIDE DERIVATIVES AS ANTIVIRAL AGENTS AGAINST CORONAVIRUSES USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V. V. I. (CZ) 2025-05-15 WO disclosed
EP-4553080-A1 NUCLEOSIDE DERIVATIVES AS ANTIVIRAL AGENTS AGAINST CORONAVIRUSES Ustav Organicke Chemie a Biochemie AV CR, v.v.i. (CZ) 2025-05-14 EP disclosed
US-11306093-B2 Process for preparation of 2-(6-nitropyridin-3-yl)-9H-dipyrido[2,3-b;3′,4′-d]pyrrole HOFFMANN-LA ROCHE, INC. (US) 2022-04-19 US disclosed
CN-109689653-B For the preparation of 2- (6-nitropyridin-3-yl) -9H-bipyridino [2, 3-b; process for 3 ', 4' -d ] pyrroles 豪夫迈·罗氏有限公司 2022-04-12 CN disclosed
US-11058781-B2 Diazacarbazole derivatives as tau-PET-ligands HOFFMANN-LA ROCHE INC. 2021-07-13 US disclosed
EP-3510031-B1 PROCESS FOR PREPARATION OF 2-(6-NITROPYRIDIN-3-YL)-9H-DIPYRIDO[2,3-B;3',4'-D]PYRROLE HOFFMANN LA ROCHE (CH) 2020-12-02 EP disclosed
US-20190300529-A1 Process for preparation of 2-(6-nitropyridin-3-yl)-9H-dipyrido[2,3-b;3',4'-d]pyrrole HOFFMANN-LA ROCHE INC. (US) 2019-10-03 US disclosed
US-20180326099-A1 DIAZACARBAZOLE DERIVATIVES AS TAU-PET-LIGANDS HOFFMANN-LA ROCHE INC. (US) 2018-11-15 US disclosed
US-10004817-B2 Diazacarbazole derivatives as tau-PET-ligands HOFFMANN-LA ROCHE INC. (US) 2018-06-26 US disclosed
WO-2018046428-A1 PROCESS FOR PREPARATION OF 2-(6-NITROPYRIDIN-3-YL)-9H-DIPYRIDO[2,3-B;3',4'-D]PYRROLE F. HOFFMANN-LA ROCHE AG (CH) 2018-03-15 WO disclosed
EP-3055308-B1 DIAZACARBAZOLE DERIVATIVES AS TAU-PET-LIGANDS HOFFMANN LA ROCHE (CH) 2017-11-22 EP disclosed
EP-3055308-A1 DIAZACARBAZOLE DERIVATIVES AS TAU-PET-LIGANDS F.HOFFMANN-LA ROCHE AG (CH) 2016-08-17 EP disclosed
US-20160220712-A1 DIAZACARBAZOLE DERIVATIVES AS TAU-PET-LIGANDS HOFFMANN-LA ROCHE INC. (US) 2016-08-04 US disclosed
US-20150315127-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2015-11-05 US disclosed
WO-2015052105-A1 DIAZACARBAZOLE DERIVATIVES AS TAU-PET-LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2015-04-16 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 (7 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-10004817-B2 Diazacarbazole derivatives as tau-PET-ligands SNCA, MAPT, PSEN1 MAPT 2/4885RAB9A 1512/4885POLB 3444/4885
US-20180326099-A1 DIAZACARBAZOLE DERIVATIVES AS TAU-PET-LIGANDS SNCA, MAPT, PSEN1 MAPT 2/4885RAB9A 1512/4885POLB 3444/4885
US-20150315127-A1 THERAPEUTIC COMPOUNDS HTR2C, GRK2, GRK3 MAPT 2718/4885RAB9A 1191/4885POLB 4723/4885
US-11058781-B2 Diazacarbazole derivatives as tau-PET-ligands SNCA, MAPT, PSEN1 MAPT 2/4885RAB9A 1512/4885POLB 3444/4885
US-20160220712-A1 DIAZACARBAZOLE DERIVATIVES AS TAU-PET-LIGANDS SNCA, MAPT, PSEN1 MAPT 2/4885RAB9A 1512/4885POLB 3444/4885
US-20190300529-A1 Process for preparation of 2-(6-nitropyridin-3-yl)-9H-dipyrido[2,3-b;3',4'-d]pyrrole HBB, PAH, BOLA2; BOLA2B MAPT 4234/4885RAB9A 514/4885POLB 959/4885
US-11306093-B2 Process for preparation of 2-(6-nitropyridin-3-yl)-9H-dipyrido[2,3-b;3′,4′-d]pyrrole HBB, PAH, BOLA2; BOLA2B MAPT 4237/4885RAB9A 503/4885POLB 928/4885

“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.