SCHEMBL6035343

SCHEMBL6035343

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

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 1/20 0.45
▸ CA1 P00915 6/20 0.44
▸ CA2 P00918 6/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ GBA1 P04062 1/20 0.44
▸ TSHR P16473 1/20 0.43
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ KMT2A Q03164 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ MEN1 O00255 1/20 0.39

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
SCHEMBL3413232 0.83 ENPP2 (0.49) ENPP2CA1CA2ALDH1A1GBA1
SCHEMBL6034629 0.80 SIGMAR1 (0.53) CA1CA2ALDH1A1GBA1TSHR
SCHEMBL6598439 0.79 MEN1 (0.48) ENPP2CA1CA2ALDH1A1GBA1
SCHEMBL3915021 0.76 ALDH1A1 (0.61) ENPP2CA1CA2ALDH1A1TSHR
SCHEMBL20982132 0.76 TSHR (0.65) ENPP2CA1CA2ALDH1A1TSHR
SCHEMBL7926321 0.73 CA12 (0.62) ENPP2CA1CA2ALDH1A1TSHR
SCHEMBL387619 0.73 ENPP2 (0.55) ENPP2CA1CA2ALDH1A1CA12
SCHEMBL387555 0.71 ALDH1A1 (0.60) ENPP2CA1CA2ALDH1A1MAPT
SCHEMBL8064506 0.71 LMNA (0.55) ENPP2CA1CA2ALDH1A1TSHR
SCHEMBL23088821 0.70 SMN1; SMN2 (0.50) ENPP2CA1CA2ALDH1A1TSHR

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-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 ENPP2 479/4885CA1 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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