SCHEMBL30177971

SCHEMBL30177971

C=CC(=O)N1CCN(c2ncnc3c2CC(C)C(c2c(C)ccc4[nH]ncc24)C3)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KRAS P01116 20/20 1.00

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
SCHEMBL21733645 1.00 KRAS (1.00) KRAS
SCHEMBL30177998 1.00 KRAS (1.00) KRAS
SCHEMBL21733791 1.00 KRAS (1.00) KRAS
SCHEMBL30177766 1.00 KRAS (1.00) KRAS
SCHEMBL21259513 1.00 KRAS (1.00) KRAS
SCHEMBL21243865 1.00 KRAS (1.00) KRAS
SCHEMBL21243886 1.00 KRAS (1.00) KRAS
SCHEMBL21259493 0.90 KRAS (0.81) KRAS
SCHEMBL21263640 0.90 KRAS (0.81) KRAS
SCHEMBL21243902 0.90 KRAS (0.81) 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
US-11760744-B2 Fused ring compounds GENENTECH, INC. (US) 2023-09-19 US disclosed
US-20230002345-A1 FUSED RING COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-01-05 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 (2 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-11760744-B2 Fused ring compounds KRAS, NRAS, HRAS KRAS 1/4885
US-20230002345-A1 FUSED RING COMPOUNDS 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.