SCHEMBL4507676

SCHEMBL4507676

CN(C)c1ccc(-c2cccc3nsnc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.45
▸ KDM1A O60341 1/20 0.45
▸ MAPT P10636 9/20 0.43
▸ KDM4E B2RXH2 6/20 0.43
▸ HSD17B10 Q99714 4/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ APP P05067 2/20 0.42
▸ ALDH1A1 P00352 6/20 0.41
▸ LMNA P02545 5/20 0.41
▸ SMN1; SMN2 Q16637 5/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GLA P06280 2/20 0.40

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
SCHEMBL29637958 0.83 MAPT (0.46) POLBMAPTKDM4EHSD17B10HIF1A
SCHEMBL711589 0.83 MAPT (0.45) POLBKDM1AMAPTKDM4EHSD17B10
SCHEMBL31606747 0.83 MAPT (0.42) POLBKDM1AMAPTKDM4EHSD17B10
SCHEMBL2602433 0.81 MAPT (0.51) POLBMAPTKDM4EHSD17B10HIF1A
SCHEMBL29903995 0.80 MAPT (0.48) POLBMAPTKDM4EHSD17B10HIF1A
SCHEMBL2605854 0.79 KDM4E (0.52) POLBMAPTKDM4EHSD17B10HIF1A
SCHEMBL28664956 0.78 MAPT (0.56) POLBMAPTKDM4EHSD17B10HIF1A
SCHEMBL29004068 0.78 MAPT (0.51) POLBMAPTKDM4EHSD17B10HIF1A
SCHEMBL25475506 0.77 MAPT (0.43) POLBMAPTKDM4EHSD17B10HIF1A
SCHEMBL29171299 0.77 TDP1 (0.46) MAPTKDM4EHSD17B10HIF1AAPP

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 5 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
US-7632851-B2 Benzo[1,2,5]oxadiazoles and benzol[1,2,5]thiadiazoles useful as histopathological staining agents, imaging agents and biomarkers NOVARTIS AG (CH) 2009-12-15 — — US disclosed
US-20060093551-A1 Benzo[1,2,5]oxadiazoles and benzol[1,2,5]thiadiazoles useful as histopathological staining agents, imaging agents and biomarkers NOVARTIS AG (CH) 2006-05-04 — — 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-20230181744-A1 COMPOUND FOR PREVENTING OR TREATING LIPID METABOLISM-RELATED DISEASES MAP1LC3B, MAP1LC3A, SQSTM1 POLB 3842/4885KDM1A 2783/4885MAPT 15/4885
US-20060093551-A1 Benzo[1,2,5]oxadiazoles and benzol[1,2,5]thiadiazoles useful as histopathological staining agents, imaging agents and biomarkers H1-3, MKI67, H1-5 POLB 2487/4885KDM1A 1918/4885MAPT 2136/4885

“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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