SCHEMBL29693203

SCHEMBL29693203

CC(C)(C)OC(=O)N1CCN2Cc3cc(F)c(Br)cc3OC[C@H]2C1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KRAS P01116 12/20 0.40
IDO1 P14902 2/20 0.37
USP30 Q70CQ3 2/20 0.36
HDAC6 Q9UBN7 1/20 0.35
ESR2 Q92731 1/20 0.34
DPP4 P27487 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
SCHEMBL24558105 1.00 KRAS (0.40) KRASIDO1USP30HDAC6ESR2
SCHEMBL24558218 0.88 KRAS (0.40) KRASUSP30HDAC6ESR2DPP4
SCHEMBL24558408 0.88 KRAS (0.40) KRASUSP30HDAC6ESR2DPP4
SCHEMBL23512794 0.88 KRAS (0.39) KRASUSP30ESR2
SCHEMBL29693098 0.88 KRAS (0.39) KRASUSP30ESR2
SCHEMBL28654336 0.84 KRAS (0.43) KRASDPP4
SCHEMBL4411026 0.84 USP30 (0.40) KRASUSP30ESR2
SCHEMBL29693164 0.83 KRAS (0.49) KRASUSP30HDAC6
SCHEMBL24558243 0.83 KRAS (0.49) KRASUSP30HDAC6
SCHEMBL31236075 0.83 SOS1 (0.41) KRASIDO1USP30HDAC6DPP4

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-12410187-B2 Fused tricyclic compounds useful as anticancer agents ASTRAZENECA AB (SE) 2025-09-09 US disclosed
CN-113508118-B Fused tricyclic compounds useful as anticancer agents 阿斯利康(瑞典)有限公司 2024-07-19 CN disclosed
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 (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-12410187-B2 Fused tricyclic compounds useful as anticancer agents MCL1, TP53, CCNA2 KRAS 89/4885IDO1 4481/4885USP30 4265/4885
US-20220204527-A1 FUSED TRICYCLIC COMPOUNDS USEFUL AS ANTICANCER AGENTS MCL1, TP53, CCNA2 KRAS 89/4885IDO1 4481/4885USP30 4265/4885

“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.