SCHEMBL397656

SCHEMBL397656

Nc1ncnc2cc[nH]c12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.59
PI4KA P42356 5/20 0.45
PI4K2B Q8TCG2 5/20 0.45
PI4K2A Q9BTU6 5/20 0.45
PI4KB Q9UBF8 5/20 0.45
LMNA P02545 1/20 0.45
DRD3 P35462 1/20 0.45
XDH P47989 1/20 0.45
LRRK2 Q5S007 1/20 0.45
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
ERAP1 Q9NZ08 1/20 0.41
MAP4K4 O95819 1/20 0.41
EIF4E P06730 1/20 0.39
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
LIMK1 P53667 1/20 0.38
MAPK1 P28482 2/20 0.35
EGFR P00533 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 SCHEMBL3353317 0.98 DYRK1A (0.57) DYRK1API4KAPI4K2BPI4K2API4KB
Formic Acid SCHEMBL31745015 0.89 DYRK1A (0.49) DYRK1API4KAPI4K2BPI4K2API4KB
SCHEMBL3386908 0.74 DYRK1A (0.59) DYRK1AMAP4K4EIF4EMKNK1MKNK2
SCHEMBL2078428 0.74 DYRK1A (0.59) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL32425027 0.74 DYRK1A (1.00) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL23158613 0.74 DYRK1A (0.64) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL1056424 0.74 DYRK1A (0.59) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL8223 0.74 DYRK1A (1.00) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL13186164 0.74 DYRK1A (0.59) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL16809892 0.71 DYRK1A (0.55) DYRK1AEIF4EMKNK1MKNK2IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3860990-B1 INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF CANCER INVENTIVA (FR) 2022-09-14 EP claimed
CN-107803189-B Chromatography medium using 4-amino pyrrolo [3,2-D ] pyrimidine as functional ligand 苏州博进生物技术有限公司 2020-07-14 CN claimed
WO-1997049706-A1 SUBSTITUTED 7-AMINO-PYRROLO[3,2-d]PYRIMIDINES AND THE USE THEREOF NOVARTIS AG (CH) 1997-12-31 WO claimed
US-20250382305-A1 COMPOUNDS FOR TREATING SPINOCEREBELLAR ATAXIA TYPE 3 PTC THERAPEUTICS INC (US) 2025-12-18 US disclosed
US-12128047-B2 TLR7 agonist and pharmaceutical combination thereof for treating lung cancer CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-10-29 US disclosed
US-20240216316-A1 DIHOMO-GAMMA LINOLENIC ACID (DGLA) IS A NOVEL SENOLYTIC BUCK INST RES AGING (US) 2024-07-04 US disclosed
WO-2023165570-A1 CYCLOALKYL OR HETEROCYCLYL SUBSTITUTED HETEROARYL COMPOUND, AND COMPOSITION AND USE THEREOF 深圳市塔吉瑞生物医药有限公司 2023-09-07 WO disclosed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-20220071999-A1 DESIGN AND DISCOVERY OF BD OXIDASE INHIBITORS FOR THE TREATMENT OF MYCOBACTERIAL DISEASES UNIVERSITY OF NOTRE DAME DU LAC (US) 2022-03-10 US disclosed
US-11186575-B2 Treatment of helicobacter pylori infections Alber Einslein College of Medicine (US) 2021-11-30 US disclosed
EP-3897651-A1 DISCOVERY OF BD OXIDASE INHIBITORS FOR THE TREATMENT OF MYCOBACTERIAL DISEASES University of Notre Dame du Lac (US) 2021-10-27 EP disclosed
US-6040310-A 4-aminopyrrole (3,2-d) pyrimidines as neuropeptide Y receptor antagonists PFIZER INC. (US) 2000-03-21 US disclosed
US-6020492-A Deazapurine derivatives; a new class of CRF1 specific ligands NEUROGEN CORPORATION (US) 2000-02-01 US disclosed
US-5985848-A EFFECTIVE INHIBITORS OF PURINE NUCLEOSIDE PHOSPHORYLASE AND/OR NUCLEOSIDE HYDROLASES; TREATMENT AND/OR PROPHYLAXIS OF A PROTOZOAN INFECTION ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 1999-11-16 US disclosed
EP-0770080-B1 NOVEL DEAZAPURINE DERIVATIVES; A NEW CLASS OF CRF1 SPECIFIC LIGANDS NEUROGEN CORP (US) 1999-07-14 EP disclosed
WO-1999007703-A1 4-AMINOPYRROLE(3,2-d) PYRIMIDINES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 1999-02-18 WO disclosed
WO-1999007703-A1 4-AMINOPYRROLE(3,2-d) PYRIMIDINES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 1999-02-18 WO disclosed
EP-0896822-A1 4-Aminopyrrole (3,2-d) pyrimidines as neuropeptide Y receptor antagonists Pfizer Products Inc. (US) 1999-02-17 EP disclosed
WO-1997049706-A1 SUBSTITUTED 7-AMINO-PYRROLO[3,2-d]PYRIMIDINES AND THE USE THEREOF NOVARTIS AG (CH) 1997-12-31 WO disclosed
US-5644057-A Deazapurine derivatives; a new class of CRF1 specific ligands NEUROGEN CORPORATION (US) 1997-07-01 US 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 (5 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-12128047-B2 TLR7 agonist and pharmaceutical combination thereof for treating lung cancer TLR7, TLR9, TLR1 DYRK1A 1072/4885PI4KA 898/4885PI4K2B 1261/4885
US-20250382305-A1 COMPOUNDS FOR TREATING SPINOCEREBELLAR ATAXIA TYPE 3 ATXN2, SMN1; SMN2, ATXN10 DYRK1A 3549/4885PI4KA 3622/4885PI4K2B 2985/4885
US-20240216316-A1 DIHOMO-GAMMA LINOLENIC ACID (DGLA) IS A NOVEL SENOLYTIC DAGLA, DAGLB, MGLL DYRK1A 1024/4885PI4KA 3833/4885PI4K2B 3885/4885
US-20220071999-A1 DESIGN AND DISCOVERY OF BD OXIDASE INHIBITORS FOR THE TREATMENT OF MYCOBACTERIAL DISEASES NDUFB10, NDUFB3, NDUFV3 DYRK1A 3974/4885PI4KA 2809/4885PI4K2B 2450/4885
US-11186575-B2 Treatment of helicobacter pylori infections MTAP, UNG, TPMT DYRK1A 4698/4885PI4KA 2600/4885PI4K2B 3049/4885

“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.