SCHEMBL22724637

SCHEMBL22724637

Cc1ccnc(C(C)C)c1-n1c(=O)nc(O)c2cc(F)c(Cl)nc21

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KRAS P01116 20/20 0.49
SOS1 Q07889 1/20 0.46

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
SCHEMBL30957847 1.00 KRAS (0.49) KRASSOS1
Hydrochloric Acid SCHEMBL30957877 0.99 KRAS (0.49) KRASSOS1
SCHEMBL28557210 0.92 KRAS (0.42) KRASSOS1
SCHEMBL20560390 0.92 KRAS (0.48) KRAS
SCHEMBL28559212 0.91 KRAS (0.42) KRASSOS1
SCHEMBL24459922 0.91 KRAS (0.47) KRAS
Hydrochloric Acid SCHEMBL31636208 0.91 KRAS (0.47) KRAS
SCHEMBL28563035 0.90 KRAS (0.42) KRASSOS1
SCHEMBL29614874 0.89 KRAS (0.40) KRASSOS1
SCHEMBL28566364 0.88 KRAS (0.42) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11345701-B1 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-05-31 US disclosed
US-11161847-B2 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2021-11-02 US disclosed
US-20210300920-A1 KRAS Mutant Protein Inhibitors JACOBIO PHARMACEUTICALS CO., LTD (CN) 2021-09-30 US disclosed
WO-2020239123-A1 AROMATIC HETEROCYCLIC DERIVATIVE MODULATOR AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2020-12-03 WO 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-20210300920-A1 KRAS Mutant Protein Inhibitors KRAS, NRAS, APC KRAS 1/4885SOS1 119/4885
US-11161847-B2 KRAS mutant protein inhibitors KRAS, NRAS, APC KRAS 1/4885SOS1 119/4885
US-11345701-B1 KRAS mutant protein inhibitors KRAS, NRAS, APC KRAS 1/4885SOS1 119/4885

“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.