SCHEMBL6462882

SCHEMBL6462882

CON(C)C(=O)C(CCc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.64
BTK Q06187 1/20 0.64
CTSK P43235 4/20 0.61
CTSS P25774 3/20 0.61
CTSL P07711 1/20 0.49
CTSB P07858 1/20 0.49
PPARA Q07869 2/20 0.48
PPARG P37231 1/20 0.48
SCN9A Q15858 1/20 0.48
ACE P12821 1/20 0.47

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
SCHEMBL3763894 1.00 JAK3 (0.64) JAK3BTKCTSKCTSSCTSL
SCHEMBL3720453 1.00 JAK3 (0.64) JAK3BTKCTSKCTSSCTSL
SCHEMBL20374864 0.94 JAK3 (0.61) JAK3BTKCTSKCTSSCTSL
SCHEMBL5806085 0.93 JAK3 (0.68) JAK3BTKCTSKCTSSCTSL
SCHEMBL3718681 0.93 JAK3 (0.68) JAK3BTKCTSKCTSSCTSL
SCHEMBL18409020 0.89 JAK3 (0.55) JAK3BTKCTSKCTSSPPARA
SCHEMBL7035410 0.89 JAK3 (0.54) JAK3BTKCTSKCTSSCTSL
SCHEMBL6163545 0.89 CTSK (0.65) JAK3BTKCTSKCTSSCTSL
SCHEMBL6163542 0.89 CTSK (0.65) JAK3BTKCTSKCTSSCTSL
SCHEMBL1204211 0.88 JAK3 (0.61) JAK3BTKCTSKCTSSCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1516877-A1 Amine derivatives as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-23 EP disclosed
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 US disclosed
US-20030092634-A1 Novel compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. 2003-05-15 US disclosed
WO-2002048097-A9 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF PARASITIC INFECTIONS CORVAS INT INC (US) 2003-05-08 WO disclosed
US-6506733-B1 Which process comprises hydrogenating a compound of Formula 9: presence of a catalytic amount of 20% palladium hydroxide on carbon. AXYS PHARMACEUTICALS, INC. 2003-01-14 US disclosed
US-20020107266-A1 Compounds, compositions and methods for treatment of parasitic infections DENDREON CORPORATION 2002-08-08 US disclosed
WO-2002048097-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF PARASITIC INFECTIONS CORVAS INTERNATIONAL, INC. (US) 2002-06-20 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 (3 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-20020107266-A1 Compounds, compositions and methods for treatment of parasitic infections CAT, CTSA, CTRL JAK3 3877/4885BTK 3325/4885CTSK 17/4885
US-20030092634-A1 Novel compounds and compositions as protease inhibitors SERPINB1, HPN, CTRL JAK3 2527/4885BTK 2080/4885CTSK 29/4885
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ JAK3 2680/4885BTK 2525/4885CTSK 32/4885

“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.