SCHEMBL30128086

SCHEMBL30128086

CC(C)c1ccccc1-n1c(=O)nc(N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c2cc(F)c(Cl)nc21

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KRAS P01116 20/20 0.63

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
SCHEMBL28907105 1.00 KRAS (0.63) KRAS
SCHEMBL28907108 1.00 KRAS (0.63) KRAS
SCHEMBL21542651 0.93 KRAS (0.65) KRAS
SCHEMBL31745242 0.93 KRAS (0.65) KRAS
SCHEMBL21542653 0.93 KRAS (0.65) KRAS
SCHEMBL28382317 0.92 KRAS (0.60) KRAS
SCHEMBL26330108 0.92 KRAS (0.60) KRAS
SCHEMBL29551388 0.92 KRAS (0.60) KRAS
SCHEMBL21542965 0.90 KRAS (0.61) KRAS
SCHEMBL21542968 0.90 KRAS (0.61) KRAS

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
EP-4101852-A1 PYRIDOPYRIMIDINONE COMPOUND AND APPLICATION THEREOF Bebetter Med Inc. (CN) 2022-12-14 EP disclosed
US-20220389013-A1 PYRIDOPYRIMIDINONE COMPOUNDS AND APPLICATIONS THEREOF BEBETTER MED INC. (CN) 2022-12-08 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-20220389013-A1 PYRIDOPYRIMIDINONE COMPOUNDS AND APPLICATIONS THEREOF KRAS, NRAS, HRAS KRAS 1/4885

“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.