SCHEMBL6351923

SCHEMBL6351923

CC(C)C1SC=C(c2ccc(F)cc2)N(CC(=O)N[C@@H](Cc2ccccc2)C(=O)C(=O)O)C1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OXTR P30559 1/20 0.39
CMA1 P23946 10/20 0.38
CTRC Q99895 1/20 0.38
GPR34 Q9UPC5 1/20 0.37
ALDH1A1 P00352 2/20 0.37
CAPN1 P07384 2/20 0.37
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.35

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
SCHEMBL6351926 1.00 OXTR (0.39) OXTRCMA1CTRCGPR34ALDH1A1
SCHEMBL6347131 0.95 POLB (0.39) ALDH1A1CAPN1POLB
SCHEMBL6347128 0.95 POLB (0.39) ALDH1A1CAPN1POLB
SCHEMBL6348272 0.90 CAPN1 (0.40) ALDH1A1CAPN1POLB
SCHEMBL6348278 0.90 CAPN1 (0.40) ALDH1A1CAPN1POLB
SCHEMBL6358276 0.85 POLB (0.35) OXTRCMA1CTRCGPR34ALDH1A1
SCHEMBL6356914 0.83 POLB (0.38) ALDH1A1CAPN1POLB
SCHEMBL6356918 0.83 POLB (0.38) ALDH1A1CAPN1POLB
SCHEMBL6348393 0.80 POLB (0.38) ALDH1A1POLB
SCHEMBL6350484 0.79 ALDH1A1 (0.38) ALDH1A1

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 3 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

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 OXTR 964/4885CMA1 1/4885CTRC 17/4885

“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.