SCHEMBL6034629

SCHEMBL6034629

CC(CNS(=O)(=O)c1ccc(Br)cc1)N(C)C

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.53
▸ CA1 P00915 5/20 0.47
▸ CA2 P00918 5/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ GBA1 P04062 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ CYP19A1 P11511 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ MMP1 P03956 2/20 0.45
▸ MMP2 P08253 2/20 0.45
▸ MMP9 P14780 2/20 0.45
▸ MMP13 P45452 2/20 0.45
▸ MMP3 P08254 1/20 0.45
▸ MMP7 P09237 1/20 0.45
▸ MMP8 P22894 1/20 0.44

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
SCHEMBL2934786 0.83 ALDH1A1 (0.67) SIGMAR1CA1CA2ALDH1A1GBA1
SCHEMBL6035343 0.80 ENPP2 (0.45) CA1CA2ALDH1A1GBA1MAPT
SCHEMBL3412348 0.80 CA1 (0.52) SIGMAR1CA1CA2ALDH1A1GBA1
SCHEMBL6321465 0.80 CA1 (0.52) SIGMAR1CA1CA2ALDH1A1GBA1
SCHEMBL3412102 0.80 CA1 (0.52) SIGMAR1CA1CA2ALDH1A1GBA1
SCHEMBL6324078 0.80 SIGMAR1 (0.51) SIGMAR1CA1CA2ALDH1A1GBA1
SCHEMBL6597702 0.77 GAA (0.49) SIGMAR1CA1CA2ALDH1A1GBA1
SCHEMBL27287741 0.76 GRIA4 (0.56) SIGMAR1ALDH1A1GBA1MAPTCYP19A1
SCHEMBL6179006 0.76 GRIA4 (0.56) SIGMAR1ALDH1A1GBA1MAPTCYP19A1
SCHEMBL1348425 0.75 TSHR (0.73) SIGMAR1CA2ALDH1A1TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060052396-A1 Arylamines for the treatment of conditions associated with gsk-3 ASTRAZENECA (SE) 2006-03-09 — — US claimed
EP-1414801-A1 ARYLAMINES FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH GSK-3 AstraZeneca AB (SE) 2004-05-06 — — EP claimed
WO-2003004472-A1 ARYLAMINES FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH GSK-3 ASTRAZENECA AB (SE) 2003-01-16 — — WO claimed
US-20060052396-A1 Arylamines for the treatment of conditions associated with gsk-3 ASTRAZENECA (SE) 2006-03-09 — — US disclosed
EP-1414801-A1 ARYLAMINES FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH GSK-3 AstraZeneca AB (SE) 2004-05-06 — — EP disclosed
WO-2003004472-A1 ARYLAMINES FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH GSK-3 ASTRAZENECA AB (SE) 2003-01-16 — — WO 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-20060052396-A1 Arylamines for the treatment of conditions associated with gsk-3 GSK3A, GSK3B, PYGL SIGMAR1 289/4885CA1 4804/4885CA2 3873/4885

“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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