SCHEMBL7568069

SCHEMBL7568069

Cc1ccc(S(=O)(=O)N[C@H](CO)CCO)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 8/20 0.54
▸ CA9 Q16790 4/20 0.54
▸ CA12 O43570 2/20 0.54
▸ CA1 P00915 6/20 0.52
▸ CA4 P22748 1/20 0.52
▸ MMP2 P08253 4/20 0.51
▸ CA14 Q9ULX7 1/20 0.51
▸ ALDH1A1 P00352 5/20 0.50
▸ SLC1A3 P43003 1/20 0.50
▸ SLC1A2 P43004 1/20 0.50
▸ SLC1A1 P43005 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ CA7 P43166 3/20 0.49
▸ MMP1 P03956 3/20 0.49
▸ MMP9 P14780 3/20 0.49
▸ MMP13 P45452 3/20 0.49
▸ MMP8 P22894 2/20 0.49
▸ GBA1 P04062 1/20 0.47
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C19 P33261 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
SCHEMBL29831100 1.00 CA2 (0.54) CA2CA9CA12CA1CA4
SCHEMBL12406332 0.90 CA2 (0.58) CA2CA9CA12CA1CA4
SCHEMBL12169313 0.89 CA2 (0.65) CA2CA9CA12CA1CA4
SCHEMBL10482884 0.86 CA2 (0.57) CA2CA9CA12CA1CA4
SCHEMBL10482887 0.86 CA2 (0.57) CA2CA9CA12CA1CA4
SCHEMBL1609619 0.85 CA2 (0.55) CA2CA9CA12CA1CA4
SCHEMBL1609621 0.85 CA2 (0.55) CA2CA9CA12CA1CA4
SCHEMBL15304844 0.85 CA2 (0.49) CA2CA9CA12CA1CA4
SCHEMBL1727771 0.84 SLC1A3 (0.50) CA2CA1MMP2ALDH1A1SLC1A3
SCHEMBL2216960 0.84 SLC1A3 (0.50) CA2CA1MMP2ALDH1A1SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3264928-B2 — — 2002-03-11 — — JP claimed
EP-0638068-B1 PROCESS FOR THE MANUFACTURE OF (S)-3-AMINO-1-SUBSTITUTED-PYRROLIDINES WARNER LAMBERT CO (US) 1999-06-23 — — EP claimed
EP-0638068-A1 PROCESS FOR THE MANUFACTURE OF (S)-3-AMINO-1-SUBSTITUTED-PYRROLIDINES WARNER-LAMBERT COMPANY (US) 1995-02-15 — — EP claimed
WO-1993022283-A1 PROCESS FOR THE MANUFACTURE OF (S)-3-AMINO-1-SUBSTITUTED-PYRROLIDINES WARNER-LAMBERT COMPANY (US) 1993-11-11 — — WO claimed
US-5177217-A Process for the manufacture of (S)-3-amino-1-substituted-pyrrolidines WARNER-LAMBERT COMPANY (US) 1993-01-05 — — US claimed
US-7514573-B2 Processes for the manufacture of chiral and racemic forms of 3-aminotetrahydrofurans, their salts and derivatives SAMI LABS LTD (IN) 2009-04-07 — — US disclosed
US-7514573-B2 Processes for the manufacture of chiral and racemic forms of 3-aminotetrahydrofurans, their salts and derivatives SAMI LABS LTD (IN) 2009-04-07 — — US disclosed
US-20080255377-A1 reduction of diesters of aspartic acid, then cyclization with the aid of sulfonic acids, hydrolysis using a base to give 3-(S)-aminotetrahydrofuran as its hydrochloride or p-toluenesulfonate salt, or as base itself MAJEED MUHAMMED 2008-10-16 — — US disclosed
US-20080255377-A1 reduction of diesters of aspartic acid, then cyclization with the aid of sulfonic acids, hydrolysis using a base to give 3-(S)-aminotetrahydrofuran as its hydrochloride or p-toluenesulfonate salt, or as base itself MAJEED MUHAMMED 2008-10-16 — — US disclosed
EP-0638068-B1 PROCESS FOR THE MANUFACTURE OF (S)-3-AMINO-1-SUBSTITUTED-PYRROLIDINES WARNER LAMBERT CO (US) 1999-06-23 — — EP disclosed
EP-0911322-A2 1-Benzyl-3-(S)-[2-(S)-(tert-butoxy-carbonylamino) propionylamino] -pyrrolidine and its use as an intermediate WARNER-LAMBERT COMPANY (US) 1999-04-28 — — EP disclosed
EP-0638068-A1 PROCESS FOR THE MANUFACTURE OF (S)-3-AMINO-1-SUBSTITUTED-PYRROLIDINES WARNER-LAMBERT COMPANY (US) 1995-02-15 — — EP disclosed
WO-1993022283-A1 PROCESS FOR THE MANUFACTURE OF (S)-3-AMINO-1-SUBSTITUTED-PYRROLIDINES WARNER-LAMBERT COMPANY (US) 1993-11-11 — — WO disclosed
US-5250704-A Process for the manufacture of (S)-3-amino-1-substituted-pyrrolidines WARNER-LAMBERT COMPANY (US) 1993-10-05 — — US disclosed
US-5177217-A Process for the manufacture of (S)-3-amino-1-substituted-pyrrolidines WARNER-LAMBERT COMPANY (US) 1993-01-05 — — 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-20080255377-A1 reduction of diesters of aspartic acid, then cyclization with the aid of sulfonic acids, hydrolysis using a base to give 3-(S)-aminotetrahydrofuran as its hydrochloride or p-toluenesulfonate salt, or as base itself AASDHPPT, DNPEP, ASNS CA2 1264/4885CA9 1782/4885CA12 559/4885

“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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