SCHEMBL10036144

SCHEMBL10036144

Cc1ccc2c(c1)N(CCCCS(=O)(=O)O)C(/C=C/C=C1\Sc3ccc(Cl)cc3N1CCCCS(=O)(=O)O)S2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.41
▸ RAD52 P43351 3/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ TDP1 Q9NUW8 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ USP2 O75604 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CYP2D6 P10635 4/20 0.37
▸ KIF11 P52732 2/20 0.37
▸ CLK1 P49759 2/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ LMNA P02545 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ CYP1A2 P05177 3/20 0.33
▸ CYP2C19 P33261 3/20 0.33

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
SCHEMBL19767589 0.83 MAPT (0.41) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL10036142 0.82 MAPT (0.45) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL5694880 0.82 MAPT (0.45) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL10336998 0.81 TDP1 (0.42) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL10337000 0.81 TDP1 (0.42) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL10336999 0.81 TDP1 (0.42) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL19657526 0.79 HPGD (0.46) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL13763557 0.78 MAPT (0.39) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL19651915 0.77 PDF (0.48) MAPTRAD52MAPK1KDM4ETDP1
SCHEMBL3936604 0.76 MEN1 (0.37) MEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120035187-A1 ANTI-NEURODEGENERATIVE DISEASE AGENT KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2012-02-09 — — 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 (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-20120035187-A1 ANTI-NEURODEGENERATIVE DISEASE AGENT SNCA, PSEN1, CDR2 MAPT 43/4885RAD52 4095/4885MAPK1 1135/4885

“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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