SCHEMBL24106017

SCHEMBL24106017

CCN(CC)CCCNC(=O)c1ccc2c(c1)sc1nc(-c3ccc(F)cc3)cn12

nearest known ligand 0.90

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.85
▸ THRB P10828 2/20 0.71
▸ ALDH1A1 P00352 1/20 0.68
▸ LMNA P02545 2/20 0.66
▸ SLC2A1 P11166 1/20 0.65
▸ TP53 P04637 3/20 0.63

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
SCHEMBL24619367 0.92 MAPT (0.87) MAPTTHRBLMNATP53
SCHEMBL29924730 0.92 MAPT (0.87) MAPTTHRBLMNATP53
SCHEMBL30086054 0.92 MAPT (0.87) MAPTTHRBALDH1A1LMNATP53
SCHEMBL24740847 0.92 MAPT (0.87) MAPTTHRBALDH1A1LMNATP53
SCHEMBL30085979 0.92 MAPT (0.87) MAPTTHRBALDH1A1LMNATP53
SCHEMBL24741008 0.92 MAPT (0.87) MAPTTHRBALDH1A1LMNATP53
SCHEMBL30086158 0.91 MAPT (0.77) MAPTTHRBALDH1A1LMNASLC2A1
SCHEMBL24619474 0.91 MAPT (0.77) MAPTTHRBALDH1A1LMNASLC2A1
SCHEMBL24619448 0.91 MAPT (0.85) MAPTTHRBLMNATP53
SCHEMBL24619305 0.91 MAPT (0.85) MAPTTHRBLMNATP53

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-11559518-B2 Endoplasmic reticulum stress regulator comprising benzothiazoimidazolyl compound ER STRESS RESEARCH INSTITUTE, INC. (JP) 2023-01-24 — — US disclosed
US-20210386715-A1 ENDOPLASMIC RETICULUM STRESS REGULATOR COMPRISING BENZOTHIAZOIMIDAZOLYL COMPOUND ER STRESS RESEARCH INSTITUTE, INC. (JP) 2021-12-16 — — 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 (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-11559518-B2 Endoplasmic reticulum stress regulator comprising benzothiazoimidazolyl compound HSPA5, DNAJC10, ERP44 MAPT 3116/4885THRB 1454/4885ALDH1A1 4010/4885
US-20210386715-A1 ENDOPLASMIC RETICULUM STRESS REGULATOR COMPRISING BENZOTHIAZOIMIDAZOLYL COMPOUND DNAJC10, HSPA5, ERP44 MAPT 3271/4885THRB 2208/4885ALDH1A1 4348/4885

“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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