SCHEMBL2804079

SCHEMBL2804079

CSCC[C@H](N)C(=O)OC(=O)[C@H](C)N

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.40
METAP1 P53582 1/20 0.40
RNPEP Q9H4A4 1/20 0.37
MARS1 P56192 10/20 0.36
BHMT Q93088 2/20 0.36
BHMT2 Q9H2M3 1/20 0.36
ANPEP P15144 1/20 0.35
ENPEP Q07075 1/20 0.35
CYP2C9 P11712 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
SCHEMBL20996747 0.92 RNPEP (0.42) METAP2METAP1RNPEPMARS1BHMT
SCHEMBL162031 0.92 RNPEP (0.42) METAP2METAP1RNPEPMARS1BHMT
SCHEMBL6045793 0.92 RNPEP (0.42) METAP2METAP1RNPEPMARS1BHMT
SCHEMBL5617582 0.92 RNPEP (0.42) METAP2METAP1RNPEPMARS1BHMT
Serine SCHEMBL8696833 0.89 BHMT (0.40) METAP2METAP1RNPEPMARS1BHMT
SCHEMBL5193805 0.87 METAP2 (0.42) METAP2METAP1RNPEPMARS1BHMT
SCHEMBL1289285 0.86 METAP2 (0.38) METAP2METAP1RNPEPMARS1BHMT
SCHEMBL1352749 0.86 SLC7A5 (0.42) METAP2METAP1RNPEPMARS1BHMT
SCHEMBL11531701 0.85 RNPEP (0.37) METAP2METAP1RNPEPMARS1BHMT
SCHEMBL28729561 0.85 METAP2 (0.43) METAP2METAP1RNPEPMARS1BHMT

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106834262-B A kind of linoleate isomerase mutant and its application 杭州师范大学 2019-08-16 CN claimed
CN-106834262-A A kind of linoleate isomerase mutant and its application 杭州师范大学 2017-06-13 CN claimed
CN-108642025-A The lipase mutant and its application that a kind of enzyme activity and regioselectivity improve 江南大学 2018-10-12 CN disclosed
EP-2802661-A1 MUTATED CEPHALOSPORIN HYDROXYLASE AND ITS APPLICATION IN DEACETYLCEPHALOSPORANIC ACID SYNTHESIS Orchid Chemicals and Pharmaceuticals Ltd (IN) 2014-11-19 EP disclosed
EP-2729570-A2 REAGENT USABLE FOR THE ISOLATION AND/OR PURIFICATION OF NUCLEIC ACIDS Qiagen GmbH (DE) 2014-05-14 EP disclosed
WO-2013105030-A1 MUTATED CEPHALOSPORIN HYDROXYLASE AND ITS APPLICATION IN DEACETYLCEPHALOSPORANIC ACID SYNTHESIS ORCHID CHEMICALS AND PHARMACEUTICALS LIMITED (IN) 2013-07-18 WO disclosed
WO-2013004710-A2 REAGENT USABLE FOR THE ISOLATION AND/OR PURIFICATION OF NUCLEIC ACIDS QIAGEN GMBH (DE) 2013-01-10 WO disclosed
US-20100105617-A1 C-Terminal Attachment of Two Chemical Groups to Peptides NOVO NORDISK HEALTH CARE AG (CH) 2010-04-29 US disclosed
EP-2121725-A1 C-TERMINAL ATTACHMENT OF TWO CHEMICAL GROUPS TO PEPTIDES Novo Nordisk Health Care AG (CH) 2009-11-25 EP disclosed
US-7582424-B2 Accessory cholera enterotoxin and analogs thereof as activators of calcium dependent chloride channel UNIVERSITY OF MARYLAND, BALTIMORE (US) 2009-09-01 US disclosed
WO-2008098958-A1 C-TERMINAL ATTACHMENT OF TWO CHEMICAL GROUPS TO PEPTIDES NOVO NORDISK HEALTH CARE AG (DK) 2008-08-21 WO disclosed
EP-1465908-A2 COMPOSITIONS AND METHODS FOR HYDROXYLATING EPOTHILONES Bristol-Myers Squibb Company (US) 2004-10-13 EP disclosed
EP-1365786-A2 ACCESSORY CHOLERA ENTEROTOXIN AND ANALOGS THEREOF AS ACTIVATORS OF CALCIUM DEPENDENT CHLORIDE CHANNEL Trucksis, Michele (US) 2003-12-03 EP disclosed
WO-2003057830-A2 COMPOSITIONS AND METHODS FOR HYDROXYLATING EPOTHILONES BRISTOL-MYERS SQUIBB COMPANY (US) 2003-07-17 WO disclosed
WO-2002009642-A9 ACCESSORY CHOLERA ENTEROTOXIN AND ANALOGS THEREOF AS ACTIVATORS OF CALCIUM DEPENDENT CHLORIDE CHANNEL UNIV MARYLAND (US) 2003-04-03 WO disclosed
WO-2002009642-A2 ACCESSORY CHOLERA ENTEROTOXIN AND ANALOGS THEREOF AS ACTIVATORS OF CALCIUM DEPENDENT CHLORIDE CHANNEL UNIVERSITY OF MARYLAND, BALTIMORE (US) 2002-02-07 WO disclosed
WO-2000015605-A2 CHIRAL CYANOAMINES AND METHODS OF PREPARATION TRUSTEES OF BOSTON COLLEGE (US) 2000-03-23 WO disclosed
EP-0975798-A1 METHOD TO DIAGNOSE AND TREAT PATHOLOGICAL CONDITIONS RESULTING FROM DEFICIENT ION TRANSPORT SUCH AS PSEUDOHYPOALDOSTERONISM TYPE-1 YALE UNIVERSITY (US) 2000-02-02 EP disclosed
WO-1998040516-A1 METHOD TO DIAGNOSE AND TREAT PATHOLOGICAL CONDITIONS RESULTING FROM DEFICIENT ION TRANSPORT SUCH AS PSEUDOHYPOALDOSTERONISM TYPE-1 YALE UNIVERSITY (US) 1998-09-17 WO disclosed
US-4345032-A THIOAMINOACIDS, FECES SEIKENKAI (JP) 1982-08-17 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-20100105617-A1 C-Terminal Attachment of Two Chemical Groups to Peptides PTMS, DNPEP, VIP METAP2 34/4885METAP1 64/4885RNPEP 25/4885

“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.