SCHEMBL6801020

SCHEMBL6801020

CNC(=O)[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)NC(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.58
CTSB P07858 1/20 0.58
CTSS P25774 1/20 0.58
CTSK P43235 1/20 0.58
PTPRB P23467 10/20 0.57
TACR1 P25103 2/20 0.57
F2 P00734 3/20 0.56
PRSS1 P07477 3/20 0.56
PRSS2 P07478 3/20 0.56
PRSS3 P35030 3/20 0.56

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
SCHEMBL3478169 1.00 CTSL (0.58) CTSLCTSBCTSSCTSKPTPRB
SCHEMBL3478166 1.00 CTSL (0.58) CTSLCTSBCTSSCTSKPTPRB
SCHEMBL15627733 0.88 CTSL (0.72) CTSLCTSBCTSSCTSKTACR1
SCHEMBL805151 0.88 CTSL (0.72) CTSLCTSBCTSSCTSKTACR1
SCHEMBL13924735 0.86 CTSL (0.66) CTSLCTSBCTSSCTSKTACR1
SCHEMBL10706786 0.83 HDAC8 (0.68) CTSLCTSBCTSSCTSKTACR1
SCHEMBL6803112 0.83 CTSL (0.56) CTSLCTSBCTSSPTPRB
SCHEMBL6768390 0.82 ITGB3 (0.57) CTSLCTSBCTSSCTSKTACR1
SCHEMBL6803683 0.81 CTSL (0.54) CTSLCTSSCTSKPTPRB
SCHEMBL6803693 0.81 CTSL (0.54) CTSLCTSSCTSKPTPRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004074238-A1 PHENETHYLAMINO SULFAMIC ACIDS THE PROCTER & GAMBLE COMPANY (US) 2004-09-02 WO claimed
US-20040167183-A1 Phenethylamino sulfamic acids THE PROCTER & GAMBLE COMPANY 2004-08-26 US claimed
US-7769575-B2 Three dimensional coordinates of HPTPbeta Warner Chilcott, LLC (US) 2010-08-03 US disclosed
US-7769575-B2 Three dimensional coordinates of HPTPbeta Warner Chilcott, LLC (US) 2010-08-03 US disclosed
US-20100030487-A1 THREE DIMENSIONAL COORDINATES OF HPTPbeta Aerpio Pharmaceuticals, Inc. 2010-02-04 US disclosed
US-20100030487-A1 THREE DIMENSIONAL COORDINATES OF HPTPbeta Aerpio Pharmaceuticals, Inc. 2010-02-04 US disclosed
US-7507568-B2 Three dimensional coordinates of HPTPbeta THE PROCTOR & GAMBLE COMPANY (US) 2009-03-24 US disclosed
US-7507568-B2 Three dimensional coordinates of HPTPbeta THE PROCTOR & GAMBLE COMPANY (US) 2009-03-24 US disclosed
WO-2004074238-A1 PHENETHYLAMINO SULFAMIC ACIDS THE PROCTER & GAMBLE COMPANY (US) 2004-09-02 WO disclosed
US-20040167183-A1 Phenethylamino sulfamic acids THE PROCTER & GAMBLE COMPANY 2004-08-26 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-20040167183-A1 Phenethylamino sulfamic acids PTPRM, PTPRS, PTPRE CTSL 2677/4885CTSB 2219/4885CTSS 1861/4885

“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.