SCHEMBL21749674

SCHEMBL21749674

COc1cc(-c2ccccc2)ccc1C(=O)Cn1cc(S(=O)(=O)N2CCCC2)ccc1=O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ALDH1A1 P00352 7/20 0.46
▸ GAA P10253 1/20 0.46
▸ TP53 P04637 1/20 0.44
▸ POLB P06746 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL22050825 0.89 MAPT (0.50) L3MBTL1ALDH1A1GAAPOLBMEN1
SCHEMBL21749673 0.88 ALDH1A1 (0.50) L3MBTL1ALDH1A1GAAPOLBMEN1
SCHEMBL21749680 0.86 ALDH1A1 (0.48) L3MBTL1ALDH1A1GAAMEN1KMT2A
SCHEMBL22050842 0.86 ALDH1A1 (0.52) ALDH1A1GAAKMT2ASMN1; SMN2HTT
SCHEMBL18038951 0.82 L3MBTL1 (0.52) L3MBTL1ALDH1A1GAAPOLBSMN1; SMN2
SCHEMBL18038979 0.82 L3MBTL1 (0.52) L3MBTL1ALDH1A1GAAPOLBSMN1; SMN2
SCHEMBL18038965 0.82 L3MBTL1 (0.52) L3MBTL1ALDH1A1GAATP53POLB
SCHEMBL18038959 0.82 L3MBTL1 (0.56) L3MBTL1ALDH1A1GAATP53POLB
SCHEMBL18038989 0.82 L3MBTL1 (0.56) L3MBTL1ALDH1A1GAATP53POLB
SCHEMBL18038954 0.82 L3MBTL1 (0.56) L3MBTL1ALDH1A1GAATP53POLB

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-11311523-B2 Pyridinone compound and use thereof KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2022-04-26 — — US disclosed
US-20200061039-A1 PYRIDINONE COMPOUND AND USE THEREOF KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2020-02-27 — — 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-20200061039-A1 PYRIDINONE COMPOUND AND USE THEREOF DOCK5, DOCK2, CIB1 L3MBTL1 2940/4885ALDH1A1 49/4885GAA 4691/4885
US-11311523-B2 Pyridinone compound and use thereof DOCK5, DOCK2, CIB1 L3MBTL1 2940/4885ALDH1A1 49/4885GAA 4691/4885

“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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