SCHEMBL26906559

SCHEMBL26906559

COc1nc(N2CCC(N3CCN(C)CC3)CC2)c(C)cc1Nc1ncc(Cl)c(N(C)c2ccccc2NS(C)(=O)=O)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 14/20 0.57
▸ MET P08581 2/20 0.54
▸ ALK Q9UM73 7/20 0.51
▸ INSR P06213 6/20 0.51
▸ IGF1R P08069 6/20 0.51
▸ ROS1 P08922 2/20 0.49
▸ BMPR1B O00238 1/20 0.48
▸ PLK4 O00444 1/20 0.48
▸ STK25 O00506 1/20 0.48
▸ RIOK3 O14730 1/20 0.48
▸ CHEK1 O14757 1/20 0.48
▸ CASK O14936 1/20 0.48
▸ AURKA O14965 1/20 0.48
▸ GAK O14976 1/20 0.48
▸ DCLK1 O15075 1/20 0.48
▸ MUSK O15146 1/20 0.48
▸ EPHB6 O15197 1/20 0.48
▸ PDPK1 O15530 1/20 0.48
▸ MAP3K13 O43283 1/20 0.48
▸ DAPK3 O43293 1/20 0.48

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
SCHEMBL26906874 0.89 INSR (0.62) EGFRMETALKINSRIGF1R
SCHEMBL26906646 0.82 EGFR (0.66) EGFRMETALKINSRIGF1R
SCHEMBL26906854 0.81 INSR (0.62) EGFRMETALKINSRIGF1R
SCHEMBL29904634 0.81 ALK (0.63) EGFRMETALKINSRIGF1R
SCHEMBL26906910 0.81 ALK (0.63) EGFRMETALKINSRIGF1R
SCHEMBL26906731 0.81 EGFR (0.65) EGFRMETALKINSRIGF1R
SCHEMBL29904662 0.79 ALK (0.65) EGFRMETALKINSRIGF1R
SCHEMBL26906710 0.79 ALK (0.65) EGFRMETALKINSRIGF1R
SCHEMBL26906784 0.78 EGFR (0.59) EGFRMETALKINSRIGF1R
SCHEMBL26906663 0.78 EGFR (0.57) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228458-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME THERAPEX CO., LTD. (KR) 2024-07-11 — — US claimed
EP-4286376-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME Therapex Co., Ltd. (KR) 2023-12-06 — — EP claimed
US-20240228458-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME THERAPEX CO., LTD. (KR) 2024-07-11 — — US disclosed
EP-4286376-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME Therapex Co., Ltd. (KR) 2023-12-06 — — 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 (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-20240228458-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME EGFR, ERBB2, ERBB3 EGFR 1/4885MET 190/4885ALK 120/4885

“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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