SCHEMBL10093129

SCHEMBL10093129

COC(=O)[C@@H](NC(=O)OC(C)(C)C)c1cccc(N)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.46
CTSK P43235 1/20 0.46
KLK5 Q9Y337 2/20 0.45
S1PR3 Q99500 2/20 0.42
PPARG P37231 1/20 0.42
ADRB2 P07550 2/20 0.39
ADRB1 P08588 2/20 0.39
ADRB3 P13945 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRB2 P47870 1/20 0.39
MAPT P10636 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
SCHEMBL3618570 1.00 CTSS (0.46) CTSSCTSKKLK5S1PR3PPARG
SCHEMBL6546992 0.93 CTSK (0.47) CTSSCTSKKLK5S1PR3ADRB2
SCHEMBL2233904 0.88 CTSK (0.50) CTSSCTSKKLK5S1PR3PPARG
SCHEMBL9261922 0.88 CTSK (0.50) CTSSCTSKKLK5S1PR3PPARG
SCHEMBL11065297 0.88 CTSK (0.50) CTSSCTSKKLK5S1PR3PPARG
SCHEMBL3619414 0.85 CTSS (0.47) CTSSCTSKKLK5S1PR3PPARG
SCHEMBL15670714 0.84 CTSS (0.47) CTSSCTSKS1PR3PPARGGABRB1
SCHEMBL26995159 0.84 CTSS (0.47) CTSSCTSKKLK5S1PR3PPARG
SCHEMBL31506048 0.84 CTSS (0.47) CTSSCTSKKLK5S1PR3PPARG
SCHEMBL6678032 0.83 CTSS (0.47) CTSSCTSKKLK5S1PR3MAPT

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
EP-2349990-B1 ARYL-PHENYL-SULFONAMIDE-PHENYLENE COMPOUNDS AND THEIR USE PIMCO 2664 LTD (GB) 2018-05-02 EP disclosed
US-8207167-B2 Aryl-phenyl-sulfonamide-phenylene compounds and their use PIMCO 2664 LIMITED (GB) 2012-06-26 US disclosed
US-8207167-B2 Aryl-phenyl-sulfonamide-phenylene compounds and their use PIMCO 2664 LIMITED (GB) 2012-06-26 US disclosed
US-20110190302-A1 Aryl-Phenyl-Sulfonamide-Phenylene Compounds and Their Use PIMCO 2664 LIMITED (GB) 2011-08-04 US disclosed
US-20110190302-A1 Aryl-Phenyl-Sulfonamide-Phenylene Compounds and Their Use PIMCO 2664 LIMITED (GB) 2011-08-04 US disclosed
WO-2010032010-A1 ARYL-PHENYL-SULFONAMIDE-PHENYLENE COMPOUNDS AND THEIR USE PIMCO 2664 LIMITED (GB) 2010-03-25 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-20110190302-A1 Aryl-Phenyl-Sulfonamide-Phenylene Compounds and Their Use SOST, PSAP, ARSA CTSS 114/4885CTSK 240/4885KLK5 3468/4885

“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.