SCHEMBL7444358

SCHEMBL7444358

CCCCC(NCC(CCC)NC(=O)OCc1ccccc1)C(=O)CSCc1ccco1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSL P07711 4/20 0.49
CTSS P25774 3/20 0.49
CTSB P07858 3/20 0.49
CTSK P43235 3/20 0.49
MME P08473 1/20 0.41
ECE1 P42892 1/20 0.41
SIRT2 Q8IXJ6 9/20 0.39
SIRT1 Q96EB6 5/20 0.39
SIRT3 Q9NTG7 4/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SYK P43405 1/20 0.38

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
SCHEMBL7303678 0.93 CTSL (0.49) CTSLCTSSCTSBCTSKSIRT2
SCHEMBL7444362 0.86 CTSL (0.53) CTSLCTSSCTSBCTSKMME
SCHEMBL7444351 0.86 CTSL (0.53) CTSLCTSSCTSBCTSKMME
SCHEMBL7431812 0.86 CTSL (0.55) CTSLCTSSCTSBCTSKMME
SCHEMBL7431820 0.86 CTSL (0.55) CTSLCTSSCTSBCTSKMME
SCHEMBL7309495 0.86 CTSL (0.42) CTSLCTSSCTSBCTSKUSP2
SCHEMBL7300828 0.85 CTSL (0.49) CTSLCTSSCTSBCTSKMME
SCHEMBL7300834 0.85 CTSL (0.49) CTSLCTSSCTSBCTSKMME
SCHEMBL7303857 0.84 CTSL (0.43) CTSLCTSSCTSBCTSKUSP2
SCHEMBL7310742 0.84 CTSL (0.47) CTSLCTSSCTSBCTSK

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
EP-0525420-B1 Pseudopeptides and dipeptides characterised by a substituted methyl ketone moiety at the C-terminus as thiol protease inhibitors MITSUBISHI CHEM CORP (JP) 1999-05-12 EP disclosed
US-5639783-A POTENT PROTEASE INHIBITOR FOR TREATING MUSCULAR, NERVOUS SYSTEM DISEASES MITSUBISHI CHEMICAL CORPORATION (JP) 1997-06-17 US disclosed