SCHEMBL25338626

SCHEMBL25338626

COc1cc2c(cc1Nc1ncc(Cl)c(Nc3ccc(OS(=O)(=O)F)cc3P(C)(C)=O)n1)CN(C(=O)O)CC2

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 11/20 0.61
▸ ALK Q9UM73 9/20 0.56
▸ INSR P06213 1/20 0.52

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
SCHEMBL25340318 0.92 MAP4K1 (0.57) MAP4K1ALKINSR
SCHEMBL30183984 0.92 MAP4K1 (0.57) MAP4K1ALKINSR
SCHEMBL30183907 0.90 MAP4K1 (0.56) MAP4K1ALKINSR
SCHEMBL31315699 0.90 MAP4K1 (0.75) MAP4K1ALKINSR
SCHEMBL25947722 0.90 MAP4K1 (0.75) MAP4K1ALKINSR
Hydrochloric Acid SCHEMBL30184063 0.90 MAP4K1 (0.74) MAP4K1ALKINSR
Hydrochloric Acid SCHEMBL29172283 0.90 MAP4K1 (0.74) MAP4K1ALKINSR
SCHEMBL29172265 0.88 ALK (0.63) MAP4K1ALKINSR
SCHEMBL25338924 0.88 MAP4K1 (0.66) MAP4K1ALKINSR
SCHEMBL32685271 0.88 MAP4K1 (0.59) MAP4K1ALKINSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117730083-A Pyrimidine compounds as MAP4K1 inhibitors 格兰马克专业公司 2024-03-19 — — CN disclosed
US-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALITY S.A. (CH) 2023-07-20 — — US 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-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS MAP4K1, MAP3K4, MAP4K2 MAP4K1 1/4885ALK 2067/4885INSR 3399/4885

“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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