SCHEMBL2374034

SCHEMBL2374034

Cc1cc([N+](=O)[O-])c(N)cc1Br

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 5/20 0.48
TDP1 Q9NUW8 5/20 0.48
ALDH1A1 P00352 5/20 0.48
RECQL P46063 1/20 0.47
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPT P10636 5/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 2/20 0.46
KMT2A Q03164 2/20 0.46
ALOX15 P16050 1/20 0.46
MCL1 Q07820 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CTSB P07858 1/20 0.42

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
SCHEMBL2344346 0.92 TSHR (0.52) TSHRCYP1A2CYP3A4TDP1ALDH1A1
SCHEMBL29536425 0.92 TSHR (0.52) TSHRCYP1A2CYP3A4TDP1ALDH1A1
Potassium Ion SCHEMBL3390956 0.89 TSHR (0.49) TSHRCYP1A2CYP3A4TDP1ALDH1A1
SCHEMBL30291047 0.86 CYP1A2 (0.53) TSHRCYP1A2CYP3A4TDP1ALDH1A1
SCHEMBL18398966 0.86 CYP1A2 (0.53) TSHRCYP1A2CYP3A4TDP1ALDH1A1
SCHEMBL10488867 0.86 TSHR (0.57) TSHRCYP1A2CYP3A4TDP1ALDH1A1
SCHEMBL348272 0.84 TSHR (0.59) TSHRCYP1A2CYP3A4TDP1ALDH1A1
SCHEMBL11553055 0.84 ALDH1A1 (0.53) TSHRCYP1A2CYP3A4TDP1ALDH1A1
SCHEMBL7653551 0.84 ALDH1A1 (0.53) TSHRCYP1A2CYP3A4TDP1ALDH1A1
SCHEMBL9652342 0.82 TSHR (0.57) TSHRCYP1A2CYP3A4TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9287568-B2 High performance, high durability non-precious metal fuel cell catalysts 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-03-15 US claimed
CN-101657921-B High performance, high durability non-precious metal fuel cell catalysts 3M INNOVATIVE PROPERTIES CO US 2013-06-12 CN claimed
US-20110319257-A1 HIGH PERFORMANCE, HIGH DURABILITY NON-PRECIOUS METAL FUEL CELL CATALYSTS 3M INNOVATIVE PROPERTIES COMPANY 2011-12-29 US claimed
EP-2135313-B1 HIGH PERFORMANCE, HIGH DURABILITY NON-PRECIOUS METAL FUEL CELL CATALYSTS 3M INNOVATIVE PROPERTIES CO (US) 2011-09-14 EP claimed
CN-101657921-A High-performance, high durability non-precious metal fuel cell catalysts 3M INNOVATIVE PROPERTIES CO US 2010-02-24 CN claimed
EP-4466258-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2024-11-27 EP disclosed
US-20240383875-A1 Benzimidazole Pyridine Derivatives HOFFMANN-LA ROCHE INC. (US) 2024-11-21 US disclosed
CN-118591534-A Novel benzimidazole pyridine derivatives 豪夫迈·罗氏有限公司 2024-09-03 CN disclosed
WO-2023139085-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2023-07-27 WO disclosed
US-9957236-B2 Selective inhibitors interfering with fibroblast growth factor receptor and FRS2 interaction for the prevention and treatment of cancer and other diseases LIMITED LIABILITY COMPANY “RUSSIAN PHARMACEUTICAL TECHNOLOGIES” (RU) 2018-05-01 US disclosed
US-9957236-B2 Selective inhibitors interfering with fibroblast growth factor receptor and FRS2 interaction for the prevention and treatment of cancer and other diseases LIMITED LIABILITY COMPANY “RUSSIAN PHARMACEUTICAL TECHNOLOGIES” (RU) 2018-05-01 US disclosed
US-20170183315-A1 SELECTIVE INHIBITORS INTERFERING WITH FIBROBLAST GROWTH FACTOR RECEPTOR AND FRS2 INTERACTION FOR THE PREVENTION AND TREATMENT OF CANCER AND OTHER DISEASES LIMITED LIABILITY COMPANY "RUSSIAN PHARMACEUTICAL TECHNOLOGIES" (RU) 2017-06-29 US disclosed
WO-2011126567-A1 FLAVIN DERIVATIVES BIORELIX, INC. (US) 2011-10-13 WO disclosed
EP-2135313-B1 HIGH PERFORMANCE, HIGH DURABILITY NON-PRECIOUS METAL FUEL CELL CATALYSTS 3M INNOVATIVE PROPERTIES CO (US) 2011-09-14 EP disclosed
CN-101657921-A High-performance, high durability non-precious metal fuel cell catalysts 3M INNOVATIVE PROPERTIES CO US 2010-02-24 CN disclosed
EP-2135313-A1 HIGH PERFORMANCE, HIGH DURABILITY NON-PRECIOUS METAL FUEL CELL CATALYSTS 3M Innovative Properties Company (US) 2009-12-23 EP disclosed
WO-2008127828-A1 HIGH PERFORMANCE, HIGH DURABILITY NON-PRECIOUS METAL FUEL CELL CATALYSTS 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-10-23 WO disclosed
EP-1606268-A1 HETEROCYCLIC KINASE INHIBITORS Abbott Laboratories (US) 2005-12-21 EP disclosed
US-20040254159-A1 Heterocyclic kinase inhibitors ABBOTT LABORATORIES 2004-12-16 US disclosed
WO-2004076424-A1 HETEROCYCLIC KINASE INHIBITORS ABBOTT LABORATORIES (US) 2004-09-10 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 (3 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-20040254159-A1 Heterocyclic kinase inhibitors MAP3K20, MAP3K19, MAP3K1 TSHR 4139/4885CYP1A2 2785/4885CYP3A4 3138/4885
US-20240383875-A1 Benzimidazole Pyridine Derivatives H1-3, H1-2, H1-4 TSHR 792/4885CYP1A2 8/4885CYP3A4 23/4885
US-20170183315-A1 SELECTIVE INHIBITORS INTERFERING WITH FIBROBLAST GROWTH FACTOR RECEPTOR AND FRS2 INTERACTION FOR THE PREVENTION AND TREATMENT OF CANCER AND OTHER DISEASES FRS2, FGFR2, FGFR1 TSHR 443/4885CYP1A2 4431/4885CYP3A4 4786/4885

“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.