SCHEMBL6671271

SCHEMBL6671271

O=C(O)CC(NS(=O)(=O)Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.57
SLC1A2 P43004 1/20 0.57
SLC1A1 P43005 1/20 0.57
ITGB3 P05106 4/20 0.52
ITGA2B P08514 3/20 0.52
MMP2 P08253 6/20 0.51
MMP9 P14780 5/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
MMP1 P03956 1/20 0.51
MMP8 P22894 1/20 0.51
MMP13 P45452 1/20 0.51
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
MME P08473 1/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
TMPRSS11D O60235 1/20 0.46

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
SCHEMBL6671273 1.00 SLC1A3 (0.57) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL7160235 0.85 SLC1A3 (0.59) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL2820939 0.85 SLC1A3 (0.59) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL6093215 0.85 ITGB3 (0.67) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL7402563 0.85 SLC1A3 (0.59) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL6668234 0.85 ITGB3 (0.67) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL5502396 0.85 ITGB3 (0.67) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL8364626 0.85 SLC1A3 (0.52) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL1509338 0.84 MMP9 (0.59) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL6670868 0.84 MMP9 (0.59) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1457487-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE CIS-PIPERIDINE DERIVATIVES Toray Fine Chemicals Co., Ltd. (JP) 2004-09-15 EP claimed
US-20040171836-A1 Method for producing optical-active cis-piperidine derivatives TORAY FINE CHEMICALS CO., LTD., A CORPORATION OF JAPAN, (JP) 2004-09-02 US claimed
EP-1457487-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE CIS-PIPERIDINE DERIVATIVES Toray Fine Chemicals Co., Ltd. (JP) 2004-09-15 EP disclosed
US-20040171836-A1 Method for producing optical-active cis-piperidine derivatives TORAY FINE CHEMICALS CO., LTD., A CORPORATION OF JAPAN, (JP) 2004-09-02 US disclosed
EP-0132373-B1 A NEUTRAL AMINO ACID COMPLEX AND A METHOD FOR OPTICAL RESOLUTION OF A DL-AMINO ACID AJINOMOTO CO., INC. (JP) 1988-10-05 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-20040171836-A1 Method for producing optical-active cis-piperidine derivatives TYR, DDC, TARBP1 SLC1A3 613/4885SLC1A2 604/4885SLC1A1 316/4885

“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.