SCHEMBL804904

SCHEMBL804904

C=C(CC)[C@@H](N)CCSC

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.40
ENPEP Q07075 1/20 0.40
RNPEP Q9H4A4 1/20 0.33
METAP2 P50579 1/20 0.31
METAP1 P53582 1/20 0.31
NOS2 P35228 2/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30

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
SCHEMBL91243 0.83 ANPEP (0.38) ANPEPENPEPRNPEP
SCHEMBL12112882 0.83 ANPEP (0.40) ANPEPENPEPRNPEP
SCHEMBL10049243 0.83 ANPEP (0.40) ANPEPENPEPRNPEP
SCHEMBL13578970 0.81 ANPEP (0.39) ANPEPENPEPRNPEP
SCHEMBL15507424 0.81 ANPEP (0.39) ANPEPENPEPRNPEP
SCHEMBL13191824 0.80 ANPEP (0.35) ANPEPENPEP
SCHEMBL13034758 0.79 ANPEP (0.38) ANPEPENPEPRNPEP
SCHEMBL12128370 0.79 ANPEP (0.34) ANPEPENPEP
SCHEMBL14501183 0.79 ANPEP (0.34) ANPEPENPEPMETAP2METAP1
SCHEMBL11896813 0.78 ANPEP (0.36) ANPEPENPEPRNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9837534-B2 Semiconductor device and fabrication method therefor SONY CORPORATION (JP) 2017-12-05 US disclosed
EP-2508612-B1 Glycosylation of molecules OXYRANE UK LTD (GB) 2017-11-29 EP disclosed
US-20170306373-A1 Alpha (1,3) Fucosyltransferases For Use In The Production of Fucosylated Oligosaccharides GINKGO BIOWORKS, INC. 2017-10-26 US disclosed
WO-2017158616-A1 CARBAPENEM COMPOUNDS ORCHID PHARMA LTD. (IN) 2017-09-21 WO disclosed
US-9765389-B2 Scanning real-time microfluidic thermocycler and methods for synchronized thermocycling and scanning optical detection BECTON, DICKINSON AND COMPANY (US) 2017-09-19 US disclosed
US-20170264364-A1 SIGNAL DECODING METHOD, SIGNAL DECODING DEVICE, AND NON-TRANSITORY COMPUTER-READABLE RECORDING MEDIUM STORING PROGRAM PANASONIC INTELLECTUAL PROPERTY CORPORATION OF AMERICA 2017-09-14 US disclosed
US-9757498-B2 Bonded alumina coating for stainless steel INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2017-09-12 US disclosed
US-9752121-B2 In vitro modelling of haematopoietic stem cell medullary nests: a tool for studying the regulation of haematopoiesis, evaluating the nesting potential of a haematopoietic graft and testing the pharmacotoxicology of medicaments ETAT FRANCAIS (MINISTERE DE LA DEFENSE), SERVICE DE SANTE DES ARMEES (FR) 2017-09-05 US disclosed
US-9752161-B2 Methods of producing isoprene and a co-product DANISCO US INC. (US) 2017-09-05 US disclosed
US-20170216524-A1 CONTINUOUS GLUCOSE MONITORING INJECTION DEVICE BECTON, DICKINSON AND COMPANY (US) 2017-08-03 US disclosed
US-20070093419-A1 Methods of treatment using specific binding agents of human angiopoietin-2 AMGEN INC. (US) 2007-04-26 US disclosed
US-7208473-B2 Nucleic acids and protein variants of hG-CSF with granulopoietic activity XENCOR, INC. (US) 2007-04-24 US disclosed
US-7205275-B2 Methods of treatment using specific binding agents of human angiopoietin-2 AMGEN INC. (US) 2007-04-17 US disclosed
US-20070072929-A1 Antibacterial and/or antiprotozoal nitromidazole derivative compounds with urease inhibitor activity, process for preparing these compounds and use in pharmaceutical compositions and medicines EMS S.A. (BR) 2007-03-29 US disclosed
US-20070055448-A1 Primary rat hepatocyte toxicity modeling GENE LOGIC INC. (US) 2007-03-08 US disclosed
US-20070042941-A1 Galectin 9-inducing factors GALPHARMA CO., LTD. (JP) 2007-02-22 US disclosed
US-20070039072-A1 Short interference RNA duplexes, when introduced into mammalian cells in culture, perform sequence-specific inhibition of target mRNA without inducing an interferon response; specific gene silencing DHARMACON INC. (US) 2007-02-15 US disclosed
US-20070027634-A1 Molecular hepatotoxicology modeling OCIMUM BIOSOLUTIONS, INC. 2007-02-01 US disclosed
US-20070012627-A1 Narrow I.D. monolithic capillary columns for high efficiency separation and high sensitivity analysis of biomolecules NORTHEASTERN UNIVERSITY 2007-01-18 US disclosed
US-20050171067-A1 Methods of treating disorders with group I mGluR antagonists BROWN UNIVERSITY (US) 2005-08-04 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 (2 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-20070072929-A1 Antibacterial and/or antiprotozoal nitromidazole derivative compounds with urease inhibitor activity, process for preparing these compounds and use in pharmaceutical compositions and medicines UMPS, PNP, UROD ANPEP 59/4885ENPEP 412/4885RNPEP 168/4885
US-20050171067-A1 Methods of treating disorders with group I mGluR antagonists GRM5, GRIK5, GRM2 ANPEP 3399/4885ENPEP 1637/4885RNPEP 2447/4885

“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.