SCHEMBL7047993

SCHEMBL7047993

CC(CCNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(=O)NCCC(C(=O)c1nc2cc(S(N)(=O)=O)ccc2o1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 3/20 0.44
CTSL P07711 2/20 0.44
CTSB P07858 2/20 0.44
CTSK P43235 2/20 0.44
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
STS P08842 4/20 0.38
ELANE P08246 1/20 0.37
MMP13 P45452 1/20 0.37
NOD2 Q9HC29 1/20 0.37
NOD1 Q9Y239 1/20 0.37
EPHX2 P34913 1/20 0.36
GPR119 Q8TDV5 2/20 0.35
TGFBR1 P36897 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL7049421 0.90 CTSL (0.44) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7046158 0.90 LMNA (0.40) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7045283 0.87 CTSS (0.57) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7183817 0.84 SMN1; SMN2 (0.39) LMNAHTTSMN1; SMN2STSMMP13
SCHEMBL7049418 0.84 SMN1; SMN2 (0.40) LMNAHTTSMN1; SMN2STSMMP13
SCHEMBL7049595 0.82 CTSL (0.42) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7047998 0.80 LMNA (0.46) CTSSLMNAHTTSMN1; SMN2STS
SCHEMBL7112203 0.78 CTSS (0.56) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7048562 0.76 LMNA (0.48) CTSSCTSLCTSBCTSKLMNA
SCHEMBL6062139 0.76 CTSS (0.45) CTSSCTSLCTSBCTSKLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ CTSS 9/4885CTSL 18/4885CTSB 11/4885

“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.