SCHEMBL7112203

SCHEMBL7112203

CC(CCNC(=O)C1CCNCC1)CC(=O)NCCC(C(=O)c1nc2cc(C(C)(C)C)ccc2o1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSS P25774 10/20 0.56
CTSL P07711 2/20 0.56
CTSB P07858 2/20 0.56
CTSK P43235 2/20 0.56
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CNR2 P34972 2/20 0.33
EPHX2 P34913 1/20 0.33
MAPT P10636 1/20 0.33
PTGES O14684 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
ELANE P08246 2/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL7048562 0.90 LMNA (0.48) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7183396 0.90 CTSS (0.44) CTSSCTSLCTSBCTSKLMNA
SCHEMBL6062139 0.90 CTSS (0.45) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7049421 0.88 CTSL (0.44) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7045283 0.87 CTSS (0.57) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7046658 0.84 CTSL (0.39) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7046158 0.80 LMNA (0.40) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7183138 0.79 LMNA (0.45) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7047993 0.78 CTSS (0.44) CTSSCTSLCTSBCTSKLMNA
SCHEMBL6464575 0.76 LMNA (0.44) LMNASMN1; SMN2CNR2

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.