SCHEMBL22518893

SCHEMBL22518893

COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc(C#N)c(Nc2cc(F)ccc2N(C)S(C)(=O)=O)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 5/20 0.69
▸ MET P08581 2/20 0.69
▸ ALK Q9UM73 14/20 0.61
▸ INSR P06213 12/20 0.61
▸ IGF1R P08069 12/20 0.61
▸ PLK1 P53350 3/20 0.60
▸ BMPR1B O00238 1/20 0.54
▸ PLK4 O00444 1/20 0.54
▸ STK25 O00506 1/20 0.54
▸ RIOK3 O14730 1/20 0.54
▸ CHEK1 O14757 1/20 0.54
▸ CASK O14936 1/20 0.54
▸ AURKA O14965 1/20 0.54
▸ GAK O14976 1/20 0.54
▸ DCLK1 O15075 1/20 0.54
▸ MUSK O15146 1/20 0.54
▸ EPHB6 O15197 1/20 0.54
▸ PDPK1 O15530 1/20 0.54
▸ MAP3K13 O43283 1/20 0.54
▸ DAPK3 O43293 1/20 0.54

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
SCHEMBL22518897 0.91 EGFR (0.82) EGFRMETALKINSRIGF1R
SCHEMBL22518892 0.91 EGFR (0.83) EGFRMETALKINSRIGF1R
SCHEMBL24074211 0.85 EGFR (0.63) EGFRMETALKINSRIGF1R
SCHEMBL29045195 0.82 INSR (0.71) EGFRMETALKINSRIGF1R
SCHEMBL22518904 0.82 EGFR (0.87) EGFRMETALKINSRIGF1R
SCHEMBL21432183 0.82 EGFR (1.00) EGFRMETALKINSRIGF1R
SCHEMBL22518888 0.81 EGFR (0.82) EGFRMETALKINSRIGF1R
SCHEMBL24327332 0.80 ALK (0.67) EGFRMETALKINSRIGF1R
SCHEMBL21432250 0.79 EGFR (0.94) EGFRMETALKINSRIGF1R
SCHEMBL23378028 0.79 EGFR (0.81) EGFRMETALKINSRIGF1R

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024242360-A1 CANCER THERAPEUTIC AGENT MEDIATED BY ALK 주식회사 온코빅스 2024-11-28 — — WO claimed
EP-3722292-B1 NOVEL PYRIMIDINE DERIVATIVE HAVING EFFECT OF INHIBITING CANCER CELL GROWTH AND PHARMACEUTICAL COMPOSITION CONTAINING SAME ONCOBIX CO LTD (KR) 2023-11-01 — — EP claimed
CN-111386266-B Pyrimidine derivatives having cancer cell growth inhibiting effect and pharmaceutical compositions containing the same 昂科比克斯有限公司 2023-08-04 — — CN claimed
US-11248003-B2 Pyrimidine derivative having effect of inhibiting cancer cell growth and pharmaceutical composition containing same ONCOBIX CO., LTD. (KR) 2022-02-15 — — US claimed
US-20210147439-A1 NOVEL PYRIMIDINE DERIVATIVE HAVING EFFECT OF INHIBITING CANCER CELL GROWTH AND PHARMACEUTICAL COMPOSITION CONTAINING SAME ONCOBIX CO., LTD. (KR) 2021-05-20 — — US claimed
EP-3722292-A1 NOVEL PYRIMIDINE DERIVATIVE HAVING EFFECT OF INHIBITING CANCER CELL GROWTH AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Oncobix Co., Ltd. (KR) 2020-10-14 — — EP claimed
CN-111386266-A Novel pyrimidine derivative having cancer cell growth inhibitory effect and pharmaceutical composition comprising same 昂科比克斯有限公司 2020-07-07 — — CN claimed
WO-2024242360-A1 CANCER THERAPEUTIC AGENT MEDIATED BY ALK 주식회사 온코빅스 2024-11-28 — — WO disclosed
EP-3722292-B1 NOVEL PYRIMIDINE DERIVATIVE HAVING EFFECT OF INHIBITING CANCER CELL GROWTH AND PHARMACEUTICAL COMPOSITION CONTAINING SAME ONCOBIX CO LTD (KR) 2023-11-01 — — EP disclosed
CN-111386266-B Pyrimidine derivatives having cancer cell growth inhibiting effect and pharmaceutical compositions containing the same 昂科比克斯有限公司 2023-08-04 — — CN disclosed
US-11248003-B2 Pyrimidine derivative having effect of inhibiting cancer cell growth and pharmaceutical composition containing same ONCOBIX CO., LTD. (KR) 2022-02-15 — — US disclosed
US-20210147439-A1 NOVEL PYRIMIDINE DERIVATIVE HAVING EFFECT OF INHIBITING CANCER CELL GROWTH AND PHARMACEUTICAL COMPOSITION CONTAINING SAME ONCOBIX CO., LTD. (KR) 2021-05-20 — — US disclosed
EP-3722292-A1 NOVEL PYRIMIDINE DERIVATIVE HAVING EFFECT OF INHIBITING CANCER CELL GROWTH AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Oncobix Co., Ltd. (KR) 2020-10-14 — — EP disclosed
CN-111386266-A Novel pyrimidine derivative having cancer cell growth inhibitory effect and pharmaceutical composition comprising same 昂科比克斯有限公司 2020-07-07 — — 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 (2 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-11248003-B2 Pyrimidine derivative having effect of inhibiting cancer cell growth and pharmaceutical composition containing same MET, EGFR, TYMS EGFR 2/4885MET 1/4885ALK 94/4885
US-20210147439-A1 NOVEL PYRIMIDINE DERIVATIVE HAVING EFFECT OF INHIBITING CANCER CELL GROWTH AND PHARMACEUTICAL COMPOSITION CONTAINING SAME MET, EGFR, TYMS EGFR 2/4885MET 1/4885ALK 67/4885

“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.

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