SCHEMBL23745930

SCHEMBL23745930

C#CCCCOc1cccc(S(=O)(=O)C/C(F)=C/CNC(=O)OC(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.39
CA2 P00918 6/20 0.39
CA12 O43570 5/20 0.39
CA9 Q16790 5/20 0.39
F2 P00734 4/20 0.35
PDK2 Q15119 1/20 0.35
EGFR P00533 2/20 0.34
ITK Q08881 2/20 0.34
MAOB P27338 4/20 0.34
P4HB P07237 1/20 0.33
MAOA P21397 1/20 0.33
ALOX5 P09917 1/20 0.32

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
SCHEMBL23746019 0.87 CA1 (0.36) CA1CA2CA12CA9P4HB
SCHEMBL23745978 0.86 CA1 (0.43) CA1CA2CA12CA9P4HB
SCHEMBL23745974 0.82 CD74 (0.35)
SCHEMBL30633644 0.82 CD74 (0.35)
SCHEMBL23745931 0.81 MAOB (0.36) CA1CA2CA12CA9PDK2
SCHEMBL28549912 0.79 HSD11B1 (0.46) CA1CA2CA12CA9
SCHEMBL21693455 0.79 HSD11B1 (0.46) CA1CA2CA12CA9
SCHEMBL23745906 0.78 STAT3 (0.39) CA1CA2CA12CA9F2
SCHEMBL23746004 0.75 CA1 (0.48) CA1CA2CA12CA9EGFR
SCHEMBL21693479 0.74 CA1 (0.40) CA1CA2CA12CA9

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
US-20230349907-A1 BIOPROBES FOR LYSYL OXIDASES AND USES THEREOF PHARMAXIS LTD. (AU) 2023-11-02 US disclosed
WO-2021155439-A1 BIOPROBES FOR LYSYL OXIDASES AND USES THEREOF PHARMAXIS LTD. (AU) 2021-08-12 WO 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-20230349907-A1 BIOPROBES FOR LYSYL OXIDASES AND USES THEREOF MAOB, LOX, LPO CA1 1688/4885CA2 1164/4885CA12 1829/4885

“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.