SCHEMBL22407121

SCHEMBL22407121

c1cn(-c2c[nH]nn2)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
CYP3A4 P08684 4/20 0.39
MAPT P10636 4/20 0.38
ADH5 P11766 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.38
LMNA P02545 2/20 0.37
ENPP2 Q13822 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
NOTUM Q6P988 1/20 0.37
CYP2A6 P11509 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
IDO1 P14902 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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 SCHEMBL28179724 0.98 SMN1; SMN2 (0.39) SMN1; SMN2CYP3A4MAPTADH5LOXL2
SCHEMBL6361094 0.74
Hydrochloric Acid SCHEMBL28185877 0.72
SCHEMBL28581728 0.72 MAPT (0.61) SMN1; SMN2CYP3A4MAPTLOXL2LMNA
SCHEMBL31241182 0.72 MAPT (0.61) SMN1; SMN2CYP3A4MAPTLOXL2LMNA
SCHEMBL5797000 0.68 CYP3A4 (0.44) SMN1; SMN2CYP3A4MAPTADH5LOXL2
SCHEMBL2694847 0.68 LOXL2 (0.41) SMN1; SMN2CYP3A4MAPTLOXL2LMNA
SCHEMBL30837557 0.68 CYP3A4 (0.41) CYP3A4ADH5CYP2A6MEN1KMT2A
SCHEMBL28175006 0.68 CYP3A4 (0.60) SMN1; SMN2CYP3A4MAPTADH5LMNA
SCHEMBL17610176 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239790-A1 7-Morpholino-1,6-Naphthyridin-5-yl Derivatives and Pharmaceutical Compositions Thereof Useful as DNA-PK Inhibitor LIFEARC (GB) 2024-07-18 US disclosed
US-20240067779-A1 METALLOPOLYMERS AND ICLICK SYNTHESIS THEREOF UNIVERSITY OF TEXAS SAN ANTONIO (US) 2024-02-29 US disclosed
EP-4305032-A1 7-MORPHOLINO-1,6-NAPHTHYRIDIN-5-YL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF USEFUL AS DNA-PK INHIBITOR Admare Therapeutics Society (CA) 2024-01-17 EP disclosed
EP-4305031-A1 7-MORPHOLINO-L,6-NAPHTHYRIDIN-5-YL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF USEFUL AS DNA-PK INHIBITOR Admare Therapeutics Society (CA) 2024-01-17 EP disclosed
US-11814462-B2 Functionalized cyclic polymers and methods of preparing same UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2023-11-14 US disclosed
US-20230303600-A1 TETHERED ALKYLIDENE AND METHODS OF MAKING THE SAME NATIONAL SCIENCE FOUNDATION 2023-09-28 US disclosed
WO-2023178133-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS, INC. (US) 2023-09-21 WO disclosed
WO-2023136924-A1 TETHERED ALKYLIDENES FROM ORGANOAZIDES FOR CYCLIC POLYMER SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION INCORPORATED (US) 2023-07-20 WO disclosed
US-20230063457-A1 DNA-PK INHIBITING COMPOUNDS PROVINCIAL HEALTH SERVICES AUTHORITY (CA) 2023-03-02 US disclosed
CN-115361870-A Agrochemical composition UPL有限公司 2022-11-18 CN disclosed
CN-109843332-A Zwitterionic microgels, components thereof and related formulations and methods of use thereof 华盛顿大学 2019-06-04 CN disclosed
CN-108025286-A The composition and method comprising metal organic framework for selective olefin oligomerisation 麻省理工学院 2018-05-11 CN disclosed
CN-105992763-A Neprilysin inhibitors 施万生物制药研发IP有限责任公司 2016-10-05 CN disclosed
CN-105839151-A Even-plating agent of copper electroplating bath of HDI board used for copper interconnection and copper electroplating bath 电子科技大学 2016-08-10 CN disclosed
CN-101912381-B For treating the method and composition of ectoparasitic infection 皮埃蒙特医药品有限公司 2016-08-10 CN disclosed
CN-103249728-B Novel triazole compounds III HOFFMANN LA ROCHE 2015-01-21 CN disclosed
CN-103249728-A Novel triazole compounds III HOFFMANN LA ROCHE 2013-08-14 CN disclosed
CN-1655673-B Methods and compositions for treating ectoparasite infections PIEDMONT PHARMACEUTICALS LLC 2013-05-22 CN disclosed
CN-101912381-A Methods and compositions for treating ectoparasite infestation PIEDMONT PHARMACEUTICALS LLC 2010-12-15 CN disclosed
CN-1655673-A Methods and compositions for treating ectoparasite infections PIEDMONT PHARMACEUTICALS LLC (US) 2005-08-17 CN 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-20240239790-A1 7-Morpholino-1,6-Naphthyridin-5-yl Derivatives and Pharmaceutical Compositions Thereof Useful as DNA-PK Inhibitor DCK, ERCC2, POLK SMN1; SMN2 1965/4885CYP3A4 3272/4885MAPT 4288/4885
US-20230063457-A1 DNA-PK INHIBITING COMPOUNDS DCK, POLK, ERCC2 SMN1; SMN2 3212/4885CYP3A4 2477/4885MAPT 3302/4885
US-20230303600-A1 TETHERED ALKYLIDENE AND METHODS OF MAKING THE SAME CYCS, DNMT1, CCNY SMN1; SMN2 1421/4885CYP3A4 1115/4885MAPT 3683/4885

“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.