SCHEMBL27426474

SCHEMBL27426474

CN1CCC[C@H]1COc1nc(N2C3CCC2CN(C(=O)OC(C)(C)C)CC3)c2cc(Cl)c(-c3cc(O)cc4ccccc34)c(F)c2n1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KRAS P01116 20/20 0.59

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
SCHEMBL30686964 1.00 KRAS (0.59) KRAS
SCHEMBL29914147 1.00 KRAS (0.59) KRAS
SCHEMBL29940077 0.94 KRAS (0.60) KRAS
SCHEMBL30717282 0.94 KRAS (0.60) KRAS
SCHEMBL24697269 0.92 KRAS (0.59) KRAS
SCHEMBL30686959 0.90 KRAS (0.67) KRAS
SCHEMBL24698376 0.90 KRAS (0.67) KRAS
SCHEMBL29914145 0.90 KRAS (0.67) KRAS
SCHEMBL29125119 0.90 KRAS (0.67) KRAS
SCHEMBL29634764 0.89 KRAS (0.63) 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-20240217982-A1 KRAS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2024-07-04 US disclosed
US-20240217982-A1 KRAS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2024-07-04 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-20240217982-A1 KRAS INHIBITORS 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.