SCHEMBL23723342

SCHEMBL23723342

O=C(O)NC/C=C(\F)CS(=O)(=O)c1cccc(Cn2cc(-c3cc(OCCCc4cn(CCCCC[C@@H]5SC[C@@H]6NC(=O)N[C@@H]65)nn4)cc(OCCCc4cn(CCCCC[C@@H]5SC[C@@H]6NC(=O)N[C@@H]65)nn4)c3)nn2)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.44
CA1 P00915 6/20 0.44
CA2 P00918 6/20 0.44
CA9 Q16790 6/20 0.44
SENP1 Q9P0U3 1/20 0.43
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
OPRM1 P35372 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
SETD7 Q8WTS6 1/20 0.36
GLS O94925 1/20 0.34
PKM P14618 1/20 0.34
LYPLA2 O95372 1/20 0.34
PDE6D O43924 1/20 0.33
MYC P01106 1/20 0.33
RNF168 Q8IYW5 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
SCHEMBL30633635 0.93 CA12 (0.42) CA12CA1CA2CA9SENP1
SCHEMBL26543849 0.92 CA12 (0.43) CA12CA1CA2CA9SENP1
Hydrochloric Acid SCHEMBL23723394 0.92 CA12 (0.43) CA12CA1CA2CA9SENP1
SCHEMBL26758299 0.81 CA12 (0.47) CA12CA1CA2CA9SENP1
SCHEMBL23745934 0.81 CA12 (0.47) CA12CA1CA2CA9SENP1
Hydrochloric Acid SCHEMBL23723361 0.81 CA12 (0.46) CA12CA1CA2CA9SENP1
SCHEMBL26758307 0.77 CA12 (0.47) CA12CA1CA2CA9SENP1
SCHEMBL23745925 0.77 CA12 (0.47) CA12CA1CA2CA9SENP1
Hydrochloric Acid SCHEMBL23723230 0.76 CA12 (0.47) CA12CA1CA2CA9SENP1
SCHEMBL23745926 0.76 CA12 (0.48) CA12CA1CA2CA9SENP1

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 CA12 1829/4885CA1 1688/4885CA2 1164/4885

“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.