SCHEMBL23094232

SCHEMBL23094232

COc1ccccc1C/C(N)=N/OC(=O)COc1cccc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 9/20 1.00
▸ ALDH1A1 P00352 3/20 1.00
▸ HPGD P15428 2/20 1.00
▸ CYP1A2 P05177 2/20 0.77
▸ CYP3A4 P08684 2/20 0.77
▸ CYP2C19 P33261 2/20 0.77
▸ KDM4E B2RXH2 1/20 0.77
▸ MAPT P10636 5/20 0.73
▸ TDP1 Q9NUW8 4/20 0.73
▸ MAPK1 P28482 3/20 0.72
▸ HTT P42858 1/20 0.67
▸ SMN1; SMN2 Q16637 3/20 0.67
▸ MEN1 O00255 4/20 0.61
▸ KMT2A Q03164 4/20 0.61
▸ GAA P10253 1/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.61
▸ POLB P06746 2/20 0.52
▸ RECQL P46063 1/20 0.52
▸ LMNA P02545 2/20 0.51
▸ BLM P54132 1/20 0.51

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
SCHEMBL23094189 0.87 KDM4E (1.00) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL23094164 0.85 TDP1 (1.00) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL23094185 0.84 L3MBTL1 (0.74) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL21467764 0.84 TDP1 (1.00) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL23094171 0.84 MAPT (0.73) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL23094234 0.83 MAPT (0.76) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL23094208 0.82 L3MBTL1 (0.71) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL2182559 0.81 MAPT (1.00) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL2182563 0.81 MAPT (1.00) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4
SCHEMBL21467841 0.80 L3MBTL1 (1.00) L3MBTL1ALDH1A1HPGDCYP1A2CYP3A4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10947188-B2 Small molecule ferroptosis inducers THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2021-03-16 — — 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 (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-10947188-B2 Small molecule ferroptosis inducers GPX4, AIFM2, GPX1 L3MBTL1 2077/4885ALDH1A1 845/4885HPGD 510/4885

“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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