SCHEMBL6348434

SCHEMBL6348434

CCOC(=O)CN1C=CSC(CC)C1=O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 2/20 0.44
▸ GSK3B P49841 2/20 0.44
▸ ELANE P08246 1/20 0.42
▸ PPARG P37231 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ PIN1 Q13526 1/20 0.40
▸ PIN4 Q9Y237 1/20 0.40
▸ MAPT P10636 2/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ RIN1 Q13671 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ HTT P42858 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL22762016 0.66 GSK3A (0.45) GSK3AGSK3BELANEALDH1A1PIN1
SCHEMBL1643586 0.64 GSK3A (0.39) GSK3AGSK3BALDH1A1TDP1GAA
SCHEMBL30604703 0.64 ACE (0.46) GSK3AGSK3BELANEALDH1A1PIN1
SCHEMBL9662940 0.62 GSK3A (0.47) GSK3AGSK3BELANEALDH1A1PIN1
SCHEMBL3384734 0.62 GSK3A (1.00) GSK3AGSK3BELANEPPARGALDH1A1
SCHEMBL10369695 0.61 GSK3A (0.42) GSK3AGSK3BELANEALDH1A1PIN1
SCHEMBL11594878 0.60 ALDH1A1 (0.64) GSK3AGSK3BALDH1A1TDP1HTT
SCHEMBL19322055 0.60 TSHR (0.39) GSK3AGSK3BELANEPPARGALDH1A1
SCHEMBL1988320 0.59 ALDH1A1 (0.66) GSK3AGSK3BALDH1A1PIN1PIN4
SCHEMBL10862528 0.59 GSK3A (0.45) GSK3AGSK3BELANEPPARGALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6960575-B2 For use as inhibitors of chymase SANTEN PHARMACEUTICAL CO., LTD. (JP) 2005-11-01 — — US disclosed
US-20040097496-A1 Novel thiazine derivatives SANTEN PHARMACEUTICAL CO.,LTD. (JP) 2004-05-20 — — US disclosed
US-6713472-B1 2-OXO-1,2,3,4-TETRAHYDROPYRAZINE DERIVATIVES; CHYMASE INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2004-03-30 — — US disclosed
EP-1211249-A1 NOVEL THIAZINE OR PYRAZINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-06-05 — — EP 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-20040097496-A1 Novel thiazine derivatives CMA1, TPSD1, HRH4 GSK3A 3635/4885GSK3B 3472/4885ELANE 1077/4885

“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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