SCHEMBL3014296

SCHEMBL3014296

Nc1ncnc2cccnc12

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.52
PI4K2B Q8TCG2 1/20 0.52
PI4K2A Q9BTU6 1/20 0.52
PI4KB Q9UBF8 1/20 0.52
MAP4K4 O95819 9/20 0.49
CLK1 P49759 2/20 0.49
LIMK1 P53667 2/20 0.49
EGFR P00533 1/20 0.45
TGFBR1 P36897 4/20 0.44
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
CDC7 O00311 1/20 0.43
DBF4 Q9UBU7 1/20 0.43
PRMT5 O14744 1/20 0.43

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 SCHEMBL30575851 0.98 PI4KA (0.50) PI4KAPI4K2BPI4K2API4KBMAP4K4
SCHEMBL31065817 0.79 PRMT5 (0.41) MAP4K4CLK1LIMK1PRMT5
SCHEMBL30946645 0.74 EGFR (0.45) EGFR
SCHEMBL30831917 0.74 PDE4A (0.52) EGFR
SCHEMBL3237268 0.74 EGFR (0.45) EGFR
SCHEMBL13454691 0.74 HSP90AA1 (0.45) MAP4K4EGFRTGFBR1PRMT5
SCHEMBL7876 0.74 PDE4A (0.52) EGFR
SCHEMBL12560186 0.74 EGFR (0.49) MAP4K4EGFRPRMT5
SCHEMBL29517215 0.72 DHFR (0.54) ADORA2APRMT5
SCHEMBL3617192 0.72 DHFR (0.54) ADORA2APRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220274979-A1 2-METHYL-AZA-QUINAZOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-09-01 US claimed
EP-3976609-A1 PYRIDOPYRIMIDINES DERIVATIVES AS P2X3 INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2022-04-06 EP claimed
CN-114222741-A As P2X3Suppression ofPyridopyrimidine derivatives as agents 奇斯药制品公司 2022-03-22 CN claimed
EP-2614061-B1 QUINOLINE AND QUINOXALINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2015-05-20 EP claimed
US-12617789-B2 Small molecular inhibitors of NF-κb inducing kinase JANSSEN PHARMACEUTICA NV (BE) 2026-05-05 US disclosed
US-20250129078-A1 ERBB2 INHIBITORS COGENT BIOSCIENCES, INC. 2025-04-24 US disclosed
EP-4476211-A1 ACYLATED HETEROCYCLIC QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 Enliven Inc. (US) 2024-12-18 EP disclosed
US-20240327435-A1 AMINO-SUBSTITUTED HETEROCYCLES FOR TREATING CANCERS WITH EGFR MUTATIONS NUVALENT, INC. 2024-10-03 US disclosed
CN-114245796-B Imidazo [1,2-a ] pyridinyl derivatives and their use in the treatment of diseases 比奥根MA公司 2024-07-30 CN disclosed
US-12037346-B2 Amino-substituted heteroaryls for treating cancers with EGFR mutations NUVALENT, INC. (US) 2024-07-16 US disclosed
CN-118103370-A Fused tetracyclic quinazoline derivatives as ERBB2 inhibitors 英莱汶公司 2024-05-28 CN disclosed
EP-3630759-B1 COMPOUNDS USEFUL AS ION CHANNEL INHIBITORS FOR THE TREATMENT OF CANCER CENTRE NAT RECH SCIENT (FR) 2024-05-01 EP disclosed
US-20030171584-A1 Treating p38 mediated disorders such as arthritis, Crohns disease, irritable bowel syndrome adult respiratory distress syndrome or chronic obstructive pulmonary disease. SYNTEX (U.S.A.) LLC 2003-09-11 US disclosed
EP-1249451-A3 Bicyclic-substituted 4-amino-pyridopyrimidine derivatives Pfizer Products Inc. (US) 2003-03-12 EP disclosed
US-20030045535-A1 Bicyclic-substituted 4-amino-pyridopyrimidine derivatives PFIZER INC. 2003-03-06 US disclosed
JP-2002322178-A 4-AMINOPYRIDOPYRIMIDINE DERIVATIVE SUBSTITUTED WITH BICYCLIC GROUP PFIZER PROD INC 2002-11-08 JP disclosed
EP-1249451-A2 Bicyclic-substituted 4-amino-pyridopyrimidine derivatives Pfizer Products Inc. (US) 2002-10-16 EP disclosed
WO-2002064594-A2 6-SUBSTITUTED PYRIDO-PYRIMIDINES F. HOFFMANN-LA ROCHE AG (CH) 2002-08-22 WO disclosed
US-5223503-A Antitumor, anticarcinogenic agents ELI LILLY AND COMPANY (US) 1993-06-29 US disclosed
EP-0511792-A2 Pyridoprimidine derivatives as antineoplastic agents ELI LILLY AND COMPANY (US) 1992-11-04 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 (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-20030045535-A1 Bicyclic-substituted 4-amino-pyridopyrimidine derivatives CDK4, TYMP, CDK6 PI4KA 1515/4885PI4K2B 1813/4885PI4K2A 1902/4885
US-12037346-B2 Amino-substituted heteroaryls for treating cancers with EGFR mutations EGFR, ERBB2, ERBB3 PI4KA 2067/4885PI4K2B 2189/4885PI4K2A 2343/4885
US-20220274979-A1 2-METHYL-AZA-QUINAZOLINES AZI2, DNMT1, TPMT PI4KA 2333/4885PI4K2B 1839/4885PI4K2A 1568/4885
US-12617789-B2 Small molecular inhibitors of NF-κb inducing kinase IRAK3, IKBKB, IKBKG PI4KA 431/4885PI4K2B 632/4885PI4K2A 757/4885
US-20250129078-A1 ERBB2 INHIBITORS ERBB2, ERBB3, EGFR PI4KA 1201/4885PI4K2B 902/4885PI4K2A 1125/4885
US-20030171584-A1 Treating p38 mediated disorders such as arthritis, Crohns disease, irritable bowel syndrome adult respiratory distress syndrome or chronic obstructive pulmonary disease. ARRB1, MAPK1, MAPK8 PI4KA 1725/4885PI4K2B 1380/4885PI4K2A 1437/4885
US-20240327435-A1 AMINO-SUBSTITUTED HETEROCYCLES FOR TREATING CANCERS WITH EGFR MUTATIONS EGFR, ERBB2, ERBB4 PI4KA 934/4885PI4K2B 1433/4885PI4K2A 1234/4885

“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.