SCHEMBL23964527

SCHEMBL23964527

NCCOCCOCCOc1cc(O)cc2oc(=O)cc(-c3ccccc3)c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP1LC3B Q9GZQ8 1/20 0.56
▸ ALDH1A1 P00352 11/20 0.52
▸ MAPT P10636 5/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ MAPK1 P28482 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ HPGD P15428 3/20 0.47
▸ KDM4E B2RXH2 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ AKR1B1 P15121 2/20 0.45
▸ CA12 O43570 1/20 0.45
▸ ALDH2 P05091 1/20 0.45
▸ MAOA P21397 1/20 0.45
▸ MAOB P27338 1/20 0.45
▸ HSD17B3 P37058 1/20 0.45
▸ SORD Q00796 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ NPSR1 Q6W5P4 2/20 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
SCHEMBL23964460 0.85 MAP1LC3B (0.54) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL23964474 0.85 MAP1LC3B (0.51) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL23930263 0.81 MAP1LC3B (0.57) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL30109506 0.81 MAP1LC3B (0.57) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL31282263 0.80 ALDH1A1 (0.56) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL21648249 0.73 MAP1LC3B (0.74) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL3787335 0.73 MAP1LC3B (1.00) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL23964326 0.71 MAP1LC3B (0.44) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL30231625 0.71 MAP1LC3B (0.74) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL23964459 0.70 CYP1A1 (0.58) MAP1LC3BALDH1A1MAPTSMN1; SMN2MAPK1

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-20230181744-A1 COMPOUND FOR PREVENTING OR TREATING LIPID METABOLISM-RELATED DISEASES FUDAN UNIVERSITY (CN) 2023-06-15 — — US disclosed
WO-2021213518-A1 COMPOUND FOR PREVENTING OR TREATING LIPID METABOLISM-RELATED DISEASES 复旦大学 (CN) 2021-10-28 — — 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-20230181744-A1 COMPOUND FOR PREVENTING OR TREATING LIPID METABOLISM-RELATED DISEASES MAP1LC3B, MAP1LC3A, SQSTM1 MAP1LC3B 1/4885ALDH1A1 897/4885MAPT 15/4885

“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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