SCHEMBL30172528

SCHEMBL30172528

Oc1ccccc1C=Nc1cccc(Cl)c1N=Cc1ccccc1O.[Fe+3]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.64
▸ CA2 P00918 4/20 0.64
▸ CA9 Q16790 3/20 0.64
▸ SIRT2 Q8IXJ6 1/20 0.50
▸ ALDH1A1 P00352 6/20 0.48
▸ KDM4E B2RXH2 5/20 0.48
▸ MAPT P10636 4/20 0.48
▸ POLB P06746 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ MPI P34949 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ HPGD P15428 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ ALOX15 P16050 2/20 0.44
▸ GAA P10253 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ HTT P42858 1/20 0.44

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
SCHEMBL1946250 0.85 CA12 (0.75) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL1946252 0.85 CA12 (0.75) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL9273920 0.84 CA12 (0.68) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL9273922 0.84 CA12 (0.68) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL11413806 0.81 CA12 (0.64) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL11413807 0.81 CA12 (0.64) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL710477 0.79 CA12 (1.00) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL803089 0.79 CA12 (1.00) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL30361105 0.79 CA12 (1.00) CA12CA2CA9SIRT2ALDH1A1
SCHEMBL29359256 0.79 CA12 (1.00) CA12CA2CA9SIRT2ALDH1A1

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-20230226185-A1 METHODS AND COMPOSITIONS FOR INDUCING FERROPTOSIS IN VIVO Kojin Therapeutics, Inc. 2023-07-20 — — US disclosed
US-11541116-B1 Methods and compositions for inducing ferroptosis in vivo Kojin Therapeutics, Inc. (US) 2023-01-03 — — 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 (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-20230226185-A1 METHODS AND COMPOSITIONS FOR INDUCING FERROPTOSIS IN VIVO AIFM2, GPX4, SLC40A1 CA12 1567/4885CA2 1512/4885CA9 3247/4885
US-11541116-B1 Methods and compositions for inducing ferroptosis in vivo AIFM2, GPX4, SLC40A1 CA12 1567/4885CA2 1512/4885CA9 3247/4885

“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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