SCHEMBL23964475

SCHEMBL23964475

[N-]=[N+]=NCCOCCOCCOc1cc(O)c2c(-c3ccccc3)cc(=O)oc2c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 13/20 0.56
▸ MAP1LC3B Q9GZQ8 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ ABCB1 P08183 3/20 0.44
▸ EGFR P00533 1/20 0.43
▸ RET P07949 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL23964474 0.86 MAP1LC3B (0.51) ABCG2MAP1LC3BALDH1A1ALOX15TSHR
SCHEMBL23964459 0.81 CYP1A1 (0.58) MAP1LC3BALDH1A1ALOX15TSHRMAPK1
SCHEMBL31282322 0.76 MAP1LC3B (0.59) MAP1LC3BALDH1A1ALOX15TSHRMAPK1
SCHEMBL26172951 0.76 MAP1LC3B (0.58) MAP1LC3BALDH1A1ALOX15TSHRMAPK1
SCHEMBL25865725 0.75 MEN1 (0.59) ABCG2ALDH1A1ALOX15TSHRMAPK1
SCHEMBL3787335 0.72 MAP1LC3B (1.00) ABCG2MAP1LC3BALDH1A1ALOX15TSHR
SCHEMBL15231252 0.71 ABCG2 (1.00) ABCG2ABCB1
SCHEMBL15231635 0.71 ABCG2 (1.00) ABCG2ABCB1
SCHEMBL15940889 0.71 ABCG2 (0.58) ABCG2
SCHEMBL23964527 0.70 MAP1LC3B (0.56) MAP1LC3BALDH1A1ALOX15TSHRMAPK1

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 3 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
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 ABCG2 892/4885MAP1LC3B 1/4885ALDH1A1 897/4885

“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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