SCHEMBL7084384

SCHEMBL7084384

CC(C)C[C@@H](C(=O)O)[C@@H](C)NC(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.61
CTSS P25774 3/20 0.57
CTSL P07711 2/20 0.57
CTSB P07858 2/20 0.57
ACE2 Q9BYF1 1/20 0.55
ATM Q13315 1/20 0.53
CAPN1 P07384 1/20 0.53

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
SCHEMBL27084772 0.84 CTSK (0.58) CTSKCTSSCTSLCTSBACE2
SCHEMBL1823902 0.83 CTSK (0.76) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL2366985 0.83 CTSK (0.76) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL222158 0.83 CTSK (0.76) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL15932378 0.83 CTSL (0.58) CTSKCTSSCTSLCTSBATM
SCHEMBL15932379 0.83 CTSL (0.58) CTSKCTSSCTSLCTSBATM
SCHEMBL6841176 0.82 CTSK (0.67) CTSKCTSSCTSLCTSBACE2
SCHEMBL8909282 0.82 ATM (0.58) CTSKCTSSCTSLCTSBATM
SCHEMBL27926954 0.82 CTSK (0.67) CTSKCTSSCTSLCTSBACE2
SCHEMBL8909286 0.82 ATM (0.58) CTSKCTSSCTSLCTSBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140058-B1 N-FORMYL HYDROXYLAMINE DERIVATIVES AS ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARM (GB) 2003-11-05 EP disclosed
US-20030149084-A1 Cytostatic agents AYSCOUGH ANDREW PAUL (GB) 2003-08-07 US disclosed
US-6495597-B1 N-FORMYL HYDROXYLAMINE DERIVATIVES BRITISH BIOTECH PHARMACEUTICALS LTD. (GB) 2002-12-17 US disclosed
US-6476067-B1 N-formyl hydroxylamine derivatives as antibacterial agents BRITISH BIOTECH (GB) 2002-11-05 US disclosed
EP-1146868-A1 ANTI-INFLAMMATORY AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-10-24 EP disclosed
EP-1140058-A1 N-FORMYL HYDROXYLAMINE DERIVATIVES AS ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-10-10 EP disclosed
EP-1054861-A1 CYTOSTATIC AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-11-29 EP disclosed
WO-2000043001-A1 ANTI-INFLAMMATORY AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-07-27 WO disclosed
WO-2000035440-A1 N-FORMYL HYDROXYLAMINE DERIVATIVES AS ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-06-22 WO disclosed
WO-1999041232-A1 CYTOSTATIC AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-08-19 WO 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-20030149084-A1 Cytostatic agents MCTS1, NNMT, MMP12 CTSK 1006/4885CTSS 708/4885CTSL 395/4885

“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.