SCHEMBL30776384

SCHEMBL30776384

CN1C[C@H]2C[C@@H]1CN2c1ncnc2c(F)c(-c3ccc(F)c4sc(NC(=O)OC(C)(C)C)c(C#N)c34)c3c(c12)COC3

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KRAS P01116 2/20 0.35
HRH4 Q9H3N8 1/20 0.31
GPR119 Q8TDV5 2/20 0.31
EIF4EBP1 Q13541 1/20 0.30

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
SCHEMBL26533910 1.00 KRAS (0.35) KRASHRH4GPR119EIF4EBP1
SCHEMBL27084380 0.91 KRAS (0.37) KRASHRH4EIF4EBP1
SCHEMBL30776423 0.88 EIF4EBP1 (0.31) KRASEIF4EBP1
SCHEMBL26113915 0.87 KRAS (0.32) KRASGPR119
SCHEMBL26533798 0.87 GPR119 (0.35) KRASGPR119
SCHEMBL30587246 0.87 GPR119 (0.35) KRASGPR119
SCHEMBL26533794 0.87 GPR119 (0.35) KRASGPR119
SCHEMBL26114010 0.87 KRAS (0.34) KRAS
SCHEMBL30587289 0.87 GPR119 (0.34) KRASGPR119
SCHEMBL26532739 0.87 GPR119 (0.34) KRASGPR119

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-20250289830-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2025-09-18 US disclosed
US-12351591-B2 KRas inhibitors ELI LILLY AND COMPANY (US) 2025-07-08 US disclosed
US-20240043451-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2024-02-08 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 (3 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-20240043451-A1 KRAS INHIBITORS KRAS, NRAS, HRAS KRAS 1/4885HRH4 1410/4885GPR119 617/4885
US-12351591-B2 KRas inhibitors KRAS, NRAS, HRAS KRAS 1/4885HRH4 1410/4885GPR119 617/4885
US-20250289830-A1 KRAS INHIBITORS KRAS, NRAS, HRAS KRAS 1/4885HRH4 1410/4885GPR119 617/4885

“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.