SCHEMBL24558243

SCHEMBL24558243

CC(C)(C)OC(=O)N1CCN2Cc3cc(F)c(Br)c(F)c3OC[C@H]2C1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KRAS P01116 16/20 0.49
USP30 Q70CQ3 2/20 0.36
HDAC6 Q9UBN7 1/20 0.35
GPR119 Q8TDV5 1/20 0.34

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
SCHEMBL29693164 1.00 KRAS (0.49) KRASUSP30HDAC6GPR119
SCHEMBL24558365 0.91 KRAS (0.48) KRASUSP30HDAC6
SCHEMBL29693188 0.91 KRAS (0.50) KRAS
SCHEMBL24558209 0.91 KRAS (0.44) KRASUSP30HDAC6
SCHEMBL29693116 0.91 KRAS (0.44) KRASUSP30HDAC6
SCHEMBL24558441 0.91 KRAS (0.49) KRASUSP30HDAC6
SCHEMBL24558290 0.91 KRAS (0.50) KRAS
SCHEMBL24558309 0.91 KRAS (0.44) KRASUSP30HDAC6
SCHEMBL24558248 0.90 KRAS (0.51) KRAS
SCHEMBL29693121 0.90 KRAS (0.51) 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
EP-3935060-B1 FUSED TRICYCLIC COMPOUNDS USEFUL AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2023-11-15 EP disclosed
US-20220204527-A1 FUSED TRICYCLIC COMPOUNDS USEFUL AS ANTICANCER AGENTS ASTRAZENECA UK LIMITED (GB) 2022-06-30 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-20220204527-A1 FUSED TRICYCLIC COMPOUNDS USEFUL AS ANTICANCER AGENTS MCL1, TP53, CCNA2 KRAS 89/4885USP30 4265/4885HDAC6 797/4885

“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.