SCHEMBL23746019

SCHEMBL23746019

C#CCCCN(CCCC#C)c1cccc(S(=O)(=O)C/C(F)=C/CNC(=O)OC(C)(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.36
CA2 P00918 8/20 0.36
KCNQ4 P56696 3/20 0.35
KCNQ5 Q9NR82 3/20 0.35
P4HB P07237 1/20 0.34
ALOX5 P09917 1/20 0.33
CA12 O43570 5/20 0.32
CA9 Q16790 5/20 0.32
MTNR1A P48039 2/20 0.32
MTNR1B P49286 2/20 0.32
NQO2 P16083 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
HSD11B1 P28845 1/20 0.30

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
SCHEMBL23745930 0.87 CA1 (0.39) CA1CA2P4HBALOX5CA12
SCHEMBL23745978 0.87 CA1 (0.43) CA1CA2P4HBALOX5CA12
SCHEMBL30633632 0.82 KCNQ4 (0.35) KCNQ4KCNQ5P4HBMTNR1AMTNR1B
SCHEMBL28549912 0.79 HSD11B1 (0.46) CA1CA2CA12CA9NPC1
SCHEMBL21693455 0.79 HSD11B1 (0.46) CA1CA2CA12CA9NPC1
SCHEMBL23745906 0.79 STAT3 (0.39) CA1CA2CA12CA9HSD11B1
SCHEMBL23746004 0.76 CA1 (0.48) CA1CA2CA12CA9KDM4E
SCHEMBL30633644 0.75 CD74 (0.35)
SCHEMBL23745974 0.75 CD74 (0.35)
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 3 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
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 1164/4885KCNQ4 2735/4885

“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.