SCHEMBL24558102

SCHEMBL24558102

COc1cc2c(c(Cl)c1Br)OC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C2=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KRAS P01116 2/20 0.41
TP53 P04637 1/20 0.37
SUV39H2 Q9H5I1 6/20 0.37
USP30 Q70CQ3 1/20 0.36
PDE4B Q07343 2/20 0.35
HDAC6 Q9UBN7 1/20 0.35
TNF P01375 2/20 0.35
LITAF Q99732 2/20 0.35
ROCK2 O75116 1/20 0.34
FPR2 P25090 2/20 0.34
MMP1 P03956 1/20 0.33
MMP3 P08254 1/20 0.33
MMP7 P09237 1/20 0.33
MMP9 P14780 1/20 0.33
SMARCA2 P51531 1/20 0.33
SMARCA4 P51532 1/20 0.33
PBRM1 Q86U86 1/20 0.33

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
SCHEMBL24558242 0.91 KRAS (0.39) KRASTP53SUV39H2USP30PDE4B
SCHEMBL24558469 0.89 KRAS (0.44) KRASTP53SUV39H2USP30PDE4B
SCHEMBL29693097 0.89 KRAS (0.44) KRASTP53SUV39H2USP30PDE4B
SCHEMBL23512813 0.89 KRAS (0.40) KRASTP53USP30HDAC6FPR2
SCHEMBL29693105 0.89 KRAS (0.40) KRASTP53USP30HDAC6FPR2
SCHEMBL24558315 0.89 KRAS (0.40) KRASTP53USP30HDAC6FPR2
SCHEMBL26041581 0.89 KRAS (0.40) KRASTP53USP30HDAC6FPR2
SCHEMBL28674435 0.88 KRAS (0.43) KRAS
SCHEMBL29693130 0.85 KRAS (0.37) KRASTP53SUV39H2USP30PDE4B
SCHEMBL24558125 0.85 KRAS (0.37) KRASTP53SUV39H2USP30PDE4B

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 6 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
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
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 89/4885TP53 2/4885SUV39H2 2731/4885
US-20220204527-A1 FUSED TRICYCLIC COMPOUNDS USEFUL AS ANTICANCER AGENTS MCL1, TP53, CCNA2 KRAS 89/4885TP53 2/4885SUV39H2 2731/4885

“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.