SCHEMBL6351959

SCHEMBL6351959

CC(C)[C@@H]1SC=C(c2ccccc2)N(CC(=O)O)C1=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
ACE P12821 5/20 0.36
AKR1B1 P15121 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MME P08473 1/20 0.35
ATM Q13315 1/20 0.34
POLB P06746 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ELANE P08246 1/20 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
SCHEMBL6351956 1.00 CA12 (0.39) CA12CA9ACEAKR1B1ALDH1A1
SCHEMBL6350481 0.89 ALDH1A1 (0.38) AKR1B1ALDH1A1
SCHEMBL6350484 0.89 ALDH1A1 (0.38) AKR1B1ALDH1A1
SCHEMBL6349650 0.88 TSHR (0.39) ALDH1A1
SCHEMBL6349646 0.88 TSHR (0.39) ALDH1A1
SCHEMBL6350463 0.87 CA9 (0.41) CA9AKR1B1ALDH1A1
SCHEMBL6347128 0.80 POLB (0.39) ACEALDH1A1POLB
SCHEMBL6348393 0.78 POLB (0.38) ALDH1A1POLB
SCHEMBL6348244 0.77 L3MBTL1 (0.35) CA12CA9ACEMME
SCHEMBL6348249 0.77 L3MBTL1 (0.35) CA12CA9ACEMME

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 CA12 2292/4885CA9 624/4885ACE 5/4885

“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.