SCHEMBL29409356

SCHEMBL29409356

c1cc2cncnc2cn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.58
MKNK2 Q9HBH9 1/20 0.41
CSNK1D P48730 1/20 0.40
CSNK1E P49674 1/20 0.40
CLK1 P49759 1/20 0.40
DYRK1A Q13627 1/20 0.40
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
NCOA1 Q15788 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
MAP4K4 O95819 1/20 0.36
MINK1 Q8N4C8 1/20 0.36
TNIK Q9UKE5 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HASPIN Q8TF76 1/20 0.35
TDO2 P48775 1/20 0.35
PRKCZ Q05513 1/20 0.34

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
SCHEMBL88606 1.00 EGFR (0.58) EGFRMKNK2CSNK1DCSNK1ECLK1
Hydrochloric Acid SCHEMBL30749417 0.98 EGFR (0.56) EGFRMKNK2CSNK1DCSNK1ECLK1
Hydrochloric Acid SCHEMBL30749407 0.98 EGFR (0.56) EGFRMKNK2CSNK1DCSNK1ECLK1
Formic Acid SCHEMBL30064211 0.88 EGFR (0.47) EGFRMKNK2CSNK1DCSNK1ECLK1
SCHEMBL29409337 0.83 EGFR (0.60) EGFRMKNK2CSNK1DCSNK1ECLK1
SCHEMBL137377 0.83 EGFR (0.60) EGFRMKNK2CSNK1DCSNK1ECLK1
SCHEMBL1533934 0.82 EGFR (0.55) EGFRMKNK2CLK1PIK3CDPIK3CA
Trifluoroacetic Acid SCHEMBL30749397 0.82 EGFR (0.42) EGFRKDM4C
Isoquinoline SCHEMBL15549866 0.81 EGFR (0.77) EGFRMKNK2CLK1PIK3CDPIK3CA
Hydrochloric Acid SCHEMBL322987 0.81 EGFR (0.58) EGFRMKNK2CSNK1DCSNK1ECLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118307534-A LTA4H inhibitors and uses thereof 上海海雁医药科技有限公司 2024-07-09 CN claimed
CN-110036012-B Pyrido [3,4-d ] pyrimidine derivatives and pharmaceutically acceptable salts thereof 帝人制药株式会社 2022-05-10 CN claimed
CN-114085220-A Substituted morpholine-4-carboxylic ester derivatives, their compositions and their medical use 上海海雁医药科技有限公司 2022-02-25 CN claimed
WO-2026107076-A1 CDK2 INHIBITOR COMPOUNDS ALEKSIA THERAPEUTICS, INC. (US) 2026-05-21 WO disclosed
EP-4105213-B1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND THERAPEUTIC PHARMACEUTIC COMPOSITION COMPRISING SAME PHAROS IBIO CO LTD (KR) 2026-04-15 EP disclosed
EP-4105213-B1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND THERAPEUTIC PHARMACEUTIC COMPOSITION COMPRISING SAME PHAROS IBIO CO LTD (KR) 2026-04-15 EP disclosed
EP-4720061-A1 TREM2 AGONISTS F. Hoffmann-La Roche AG (CH) 2026-04-08 EP disclosed
WO-2025235874-A1 HETEROCYCLICS AS EGFR INHIBITORS SCHRÖDINGER, INC. (US) 2025-11-13 WO disclosed
EP-4587439-A1 SULFONE-SUBSTITUTED PYRIDO[3,4-D]PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF CANCER Bayer Aktiengesellschaft (DE) 2025-07-23 EP disclosed
CN-120091811-A Integrin inhibitors and their use in combination with other agents 普利安特治疗公司 2025-06-03 CN disclosed
WO-2025103502-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN INC. (US) 2025-05-22 WO disclosed
CN-110036012-B Pyrido [3,4-d ] pyrimidine derivatives and pharmaceutically acceptable salts thereof 帝人制药株式会社 2022-05-10 CN disclosed
WO-2022075486-A1 NOVEL BICYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2022-04-14 WO disclosed
EP-3976618-A1 TRICYCLIC COMPOUNDS Aligos Therapeutics, Inc. (US) 2022-04-06 EP disclosed
CN-114269751-A Optically pure oxaspiro-substituted pyrrolopyrazole derivatives, preparation method and medical application thereof 上海海雁医药科技有限公司 2022-04-01 CN disclosed
CN-114222737-A Small molecule inhibitor of NF-kB induced kinase 詹森药业有限公司 2022-03-22 CN disclosed
CN-114222743-A Oxoaxamembered ring pyrimidine compounds, preparation method and medical application thereof 劲方医药科技(上海)有限公司 2022-03-22 CN disclosed
US-11261182-B2 Crystal of pyrido[3,4-d]pyrimidine derivative or solvate thereof TEIJIN PHARMA LIMITED (JP) 2022-03-01 US disclosed
CN-114085220-A Substituted morpholine-4-carboxylic ester derivatives, their compositions and their medical use 上海海雁医药科技有限公司 2022-02-25 CN disclosed
CN-114026083-A Heterocyclic inhibitors of tyrosine kinases 德州大学系统董事会 2022-02-08 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 (1 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-11261182-B2 Crystal of pyrido[3,4-d]pyrimidine derivative or solvate thereof CDK6, CDK4, CDKL4 EGFR 3047/4885MKNK2 1093/4885CSNK1D 93/4885

“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.