SCHEMBL24580954

SCHEMBL24580954

CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc6c(c7c5oc5ccccc57)-c5ccccc5C6(C)C)ccc3-4)cc21

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 1/20 0.33
▸ CDC25A P30304 1/20 0.31
▸ CDC25B P30305 1/20 0.31
▸ CDC25C P30307 1/20 0.31

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
SCHEMBL20205418 0.97 ALK (0.33) ALKCDC25ACDC25BCDC25C
SCHEMBL20205328 0.95 ALK (0.32) ALKCDC25ACDC25BCDC25C
SCHEMBL24649630 0.95 ALK (0.33) ALKCDC25ACDC25BCDC25C
SCHEMBL20927645 0.94 PTPN1 (0.34) ALK
SCHEMBL20927643 0.94 ALK (0.31) ALK
SCHEMBL21785827 0.94 ALK (0.31) ALK
SCHEMBL20205365 0.94 ALK (0.31) ALK
SCHEMBL20205481 0.93 ALK (0.33) ALKCDC25ACDC25BCDC25C
SCHEMBL20205466 0.92 ALK (0.31) ALK
SCHEMBL20205329 0.92 ALK (0.31) ALK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220204520-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 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-20220204520-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM ALK 2858/4885CDC25A 2481/4885CDC25B 3012/4885

“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.

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