SCHEMBL23094164

SCHEMBL23094164

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 7/20 1.00
▸ MAPT P10636 2/20 1.00
▸ L3MBTL1 Q9Y468 5/20 0.85
▸ MAPK1 P28482 3/20 0.85
▸ HTT P42858 1/20 0.75
▸ ALDH1A1 P00352 2/20 0.73
▸ HPGD P15428 1/20 0.73
▸ SMN1; SMN2 Q16637 2/20 0.71
▸ KDM4E B2RXH2 2/20 0.65
▸ CYP1A2 P05177 2/20 0.61
▸ CYP3A4 P08684 2/20 0.61
▸ CYP2C19 P33261 2/20 0.61
▸ NPC1 O15118 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ ATM Q13315 1/20 0.56
▸ MEN1 O00255 1/20 0.55
▸ POLB P06746 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ LMNA P02545 1/20 0.53

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
SCHEMBL21467764 0.92 TDP1 (1.00) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL23094202 0.90 TDP1 (0.81) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL23094184 0.87 L3MBTL1 (1.00) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL2182563 0.86 MAPT (1.00) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL2182559 0.86 MAPT (1.00) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL23094232 0.85 L3MBTL1 (1.00) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL23094171 0.85 MAPT (0.73) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL23094183 0.84 MAPT (0.73) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL23094242 0.83 MAPT (0.72) TDP1MAPTL3MBTL1MAPK1HTT
SCHEMBL23094203 0.83 L3MBTL1 (1.00) TDP1MAPTL3MBTL1MAPK1HTT

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 TDP1 4664/4885MAPT 4344/4885L3MBTL1 2077/4885

“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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