SCHEMBL6737517

SCHEMBL6737517

Cc1ccc(CS(=O)(=O)C(CNC(=O)c2ccccc2)C(=O)NCC#N)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSL P07711 10/20 0.49
CTSS P25774 7/20 0.49
CTSK P43235 5/20 0.49
CTSB P07858 7/20 0.48
ALDH1A1 P00352 2/20 0.47
TP53 P04637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.47
CTSV O60911 2/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL6061910 0.93 CTSL (0.56) CTSLCTSSCTSKCTSBCTSV
SCHEMBL6837983 0.90 CTSB (0.55) CTSLCTSSCTSKCTSBCTSV
SCHEMBL7667375 0.90 CTSL (0.49) CTSLCTSSCTSKCTSBCTSV
SCHEMBL7666762 0.90 CTSL (0.48) CTSLCTSSCTSKCTSBCTSV
SCHEMBL6737869 0.90 CTSL (0.48) CTSLCTSSCTSKCTSB
SCHEMBL7655925 0.90 CTSL (0.49) CTSLCTSSCTSKCTSB
SCHEMBL7664695 0.90 ESRRG (0.52) CTSLCTSSCTSKCTSBTP53
SCHEMBL7654250 0.88 CTSL (0.52) CTSLCTSSCTSKCTSBCTSV
SCHEMBL6739753 0.88 CTSB (0.62) CTSLCTSSCTSKCTSBCTSV
SCHEMBL6062636 0.88 CTSL (0.46) CTSLCTSSCTSKCTSB

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-20040014796-A1 Novel compounds and compositions as cathepsin S inhititors AXYS PHARMACEUTICALS, INC. 2004-01-22 US disclosed
US-6492362-B1 Compounds and compositions as cathepsin S inhibitors AXYS PHARMACEUTICALS, INC. 2002-12-10 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-20040014796-A1 Novel compounds and compositions as cathepsin S inhititors CTSS, CTSB, CTSE CTSL 10/4885CTSS 1/4885CTSK 9/4885

“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.