SCHEMBL7084082

SCHEMBL7084082

CC(C)C[C@H](C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1)[C@@H](C)N(C=O)OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.39
FAAH O00519 1/20 0.38
IL6ST P40189 1/20 0.36
AVPR1A P37288 1/20 0.36
CTSL P07711 4/20 0.35
CTSK P43235 4/20 0.35
CTSS P25774 3/20 0.35
CTSB P07858 1/20 0.35
IDH1 O75874 5/20 0.34
NAAA Q02083 1/20 0.33
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33
CAPN1 P07384 2/20 0.33
CASP1 P29466 1/20 0.32
CASP3 P42574 1/20 0.32
CASP7 P55210 1/20 0.32
CASP6 P55212 1/20 0.32
CASP8 Q14790 1/20 0.32

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
SCHEMBL14282189 0.89 PPARA (0.44) PPARAFAAHIL6STCTSLCTSK
SCHEMBL1361232 0.81 PPARA (0.41) PPARAFAAHIL6STAVPR1ACTSL
SCHEMBL7081911 0.80 PPARA (0.44) PPARAFAAHIL6STAVPR1ACTSL
SCHEMBL16898645 0.79 PPARA (0.43) PPARAFAAHIL6STNAAA
SCHEMBL16898641 0.79 PPARA (0.43) PPARAFAAHIL6STNAAA
SCHEMBL2338946 0.78 PPARA (0.40) PPARAFAAHIL6STAVPR1ACTSL
SCHEMBL2338940 0.78 PPARA (0.40) PPARAFAAHIL6STAVPR1ACTSL
SCHEMBL7639105 0.76 PPARA (0.46) PPARAFAAHIL6STAVPR1AIDH1
SCHEMBL6671341 0.76 PPARA (0.43) PPARAFAAHIL6STIDH1NAAA
SCHEMBL3782697 0.76 PPARA (0.43) PPARAFAAHIL6STIDH1NAAA

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 9 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
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 PPARA 3346/4885FAAH 733/4885IL6ST 3698/4885

“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.