SCHEMBL7042145

SCHEMBL7042145

Cc1cccc(CS(=O)(=O)C(CNC(=O)C2CCNCC2)C(=O)NCCC(C(=O)c2nc3ccccc3o2)c2ccccc2)n1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSS P25774 18/20 0.40
CTSL P07711 2/20 0.40
CTSB P07858 2/20 0.40
CTSK P43235 2/20 0.40
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
EPHX2 P34913 1/20 0.34

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
SCHEMBL7179327 0.92 LMNA (0.38) CTSSLMNAHTTSMN1; SMN2CYP3A4
SCHEMBL7044345 0.90 CTSS (0.39) CTSSCTSLCTSBCTSKLMNA
SCHEMBL7183175 0.84 CTSS (0.39) CTSSCTSLCTSBCTSKLMNA
SCHEMBL6463875 0.84 CTSS (0.39) CTSSCTSLCTSBCTSKLMNA
SCHEMBL6468407 0.83 EPHX2 (0.38) CTSSCYP3A4CYP2C9EPHX2
SCHEMBL7043377 0.82 NPC1 (0.36) CTSSCYP3A4CYP2C9
SCHEMBL7183010 0.80 CTSS (0.37) CTSSLMNAHTTSMN1; SMN2CYP3A4
SCHEMBL7042876 0.79 CTSS (0.43) CTSSCTSLCTSBCTSKLMNA
SCHEMBL6468432 0.79 GART (0.34) CTSSHTTSMN1; SMN2CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL7114471 0.78 CTSS (0.43) 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.