SCHEMBL21928151

SCHEMBL21928151

Cc1c(CS(C)(=O)=O)cccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.37
BTK Q06187 3/20 0.37
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
CA12 O43570 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
LPL P06858 4/20 0.32
LIPG Q9Y5X9 4/20 0.32
CXCR2 P25025 2/20 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
SCHEMBL17236448 0.86 LPL (0.38) JAK2BTKCA1CA2CA9
SCHEMBL17660374 0.83 JAK2 (0.41) JAK2BTKLPLLIPGCXCR2
SCHEMBL21928363 0.82 JAK2 (0.34) JAK2BTKCA1CA2CA9
SCHEMBL21998954 0.80 ADRA1A (0.30)
SCHEMBL29288003 0.78 JAK2 (0.38) JAK2BTKLPLLIPGCXCR2
SCHEMBL20540433 0.78 JAK2 (0.39) JAK2BTKLPLLIPGCXCR2
SCHEMBL15000450 0.78 PDCD1 (0.42) JAK2BTKLPLLIPGCXCR2
SCHEMBL29712932 0.78 PDCD1 (0.42) JAK2BTKLPLLIPGCXCR2
SCHEMBL31381519 0.77 JAK2 (0.39) JAK2BTKCA1CA2CA9
SCHEMBL11927624 0.77 LPL (0.44) JAK2BTKCA1CA2CA9

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-11021486-B2 Coumarin-like cyclic compound as MEK inhibitor and use thereof CSTONE PHARMACEUTICALS (KY) 2021-06-01 US disclosed
EP-3643308-B1 COUMARIN-LIKE CYCLIC COMPOUND AS MEK INHIBITOR AND USE THEREOF CSTONE PHARMACEUTICALS (KY) 2021-05-19 EP disclosed
US-20200148695-A1 COUMARIN-LIKE CYCLIC COMPOUND AS MEK INHIBITOR AND USE THEREOF CSTONE PHARMACEUTICALS (KY) 2020-05-14 US disclosed
EP-3643308-A1 COUMARIN-LIKE CYCLIC COMPOUND AS MEK INHIBITOR AND USE THEREOF CSTONE PHARMACEUTICALS (KY) 2020-04-29 EP 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-11021486-B2 Coumarin-like cyclic compound as MEK inhibitor and use thereof MAP3K11, MAP3K15, MAP3K20 JAK2 110/4885BTK 67/4885CA1 4400/4885
US-20200148695-A1 COUMARIN-LIKE CYCLIC COMPOUND AS MEK INHIBITOR AND USE THEREOF MAP3K11, MAP3K15, MAP3K20 JAK2 110/4885BTK 67/4885CA1 4400/4885

“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.