SCHEMBL21901426

SCHEMBL21901426

CC(C)(C)OC(=O)Nc1nc2c(O)c(F)cc(F)c2s1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LCK P06239 12/20 0.46
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
PI4KB Q9UBF8 1/20 0.39
BRAF P15056 1/20 0.39

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
SCHEMBL30064634 1.00 LCK (0.46) LCKCA1CA2PI4KBBRAF
SCHEMBL21839496 0.84 LCK (0.43) LCKCA1CA2PI4KBBRAF
SCHEMBL31278527 0.82 LCK (0.42) LCKCA1CA2PI4KBBRAF
SCHEMBL21901580 0.82 LCK (0.45) LCKCA1CA2PI4KBBRAF
SCHEMBL21901456 0.81 LCK (0.41) LCKCA1CA2PI4KBBRAF
SCHEMBL28902818 0.81 LCK (0.47) LCK
SCHEMBL30231217 0.81 LCK (0.47) LCK
SCHEMBL21839452 0.79 LCK (0.40) LCKCA1CA2PI4KBBRAF
SCHEMBL21839531 0.79 NPC1 (0.39)
SCHEMBL27209852 0.79 CA1 (0.41) LCKCA1CA2PI4KBBRAF

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114195788-B Tetracyclic compounds and application thereof 苏州闻天医药科技有限公司 2024-10-01 CN disclosed
WO-2022148422-A1 BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF BEIGENE, LTD. (KY) 2022-07-14 WO disclosed
CN-112805281-B KRAS G12C inhibitors 伊莱利利公司 2022-05-10 CN disclosed
CN-114195788-A Tetracyclic compound and application thereof 苏州闻天医药科技有限公司 2022-03-18 CN disclosed
CN-112805281-A KRAS G12C inhibitors 伊莱利利公司 2021-05-14 CN disclosed
US-10968214-B2 KRas G12C inhibitors ELI LILLY AND COMPANY (US) 2021-04-06 US disclosed
WO-2020081282-A1 KRAS G12C INHIBITORS ELI LILLY AND COMPANY (US) 2020-04-23 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 (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-10968214-B2 KRas G12C inhibitors KRAS, NRAS, HRAS LCK 2013/4885CA1 3137/4885CA2 1750/4885

“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.