SCHEMBL23571876

SCHEMBL23571876

CN(C)c1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CDK7 P50613 1/20 0.59
▸ CDK9 P50750 1/20 0.59
▸ INSR P06213 4/20 0.54
▸ IGF1R P08069 4/20 0.54
▸ ALK Q9UM73 4/20 0.54
▸ MAP4K1 Q92918 7/20 0.53
▸ PTK2 Q05397 6/20 0.50
▸ AURKA O14965 1/20 0.49
▸ ROS1 P08922 1/20 0.49
▸ EML4 Q9HC35 1/20 0.49
▸ EGFR P00533 2/20 0.49

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
SCHEMBL11916362 0.84 CDK7 (0.60) CDK7CDK9INSRIGF1RALK
SCHEMBL29400320 0.84 CDK7 (0.60) CDK7CDK9INSRIGF1RALK
SCHEMBL19313060 0.83 CDK7 (0.59) CDK7CDK9INSRIGF1RALK
SCHEMBL26717249 0.83 INSR (0.72) CDK7CDK9INSRIGF1RALK
SCHEMBL29833319 0.82 CDK7 (0.61) CDK7CDK9INSRIGF1RALK
SCHEMBL13832208 0.82 CDK7 (0.61) CDK7CDK9INSRIGF1RALK
SCHEMBL14240702 0.82 CDK7 (0.58) CDK7CDK9INSRIGF1RALK
SCHEMBL19669895 0.81 CDK7 (0.66) CDK7CDK9INSRIGF1RALK
SCHEMBL24817756 0.78 CDK7 (0.62) CDK7CDK9INSRIGF1RALK
SCHEMBL23534113 0.77 ALK (0.57) CDK7CDK9INSRIGF1RALK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348399-A1 NOVEL PYRIMIDINE DERIVATIVE AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-11-02 — — US disclosed
US-20230348399-A1 NOVEL PYRIMIDINE DERIVATIVE AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-11-02 — — US disclosed
WO-2021125803-A1 NOVEL PYRIMIDIN DERIVATIVE AND USE THEREOF 한국화학연구원 2021-06-24 — — WO 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-20230348399-A1 NOVEL PYRIMIDINE DERIVATIVE AND USE THEREOF LRRK2, PFKL, PDK3 CDK7 588/4885CDK9 241/4885INSR 1636/4885

“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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