SCHEMBL5450093

SCHEMBL5450093

CC(C)(C)OC(=O)NCCc1cn(C(=O)OC(C)(C)C)cn1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
GFER P55789 1/20 0.43
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
NQO2 P16083 1/20 0.39
STK17B O94768 1/20 0.39
STK17A Q9UEE5 1/20 0.39
NAMPT P43490 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 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
SCHEMBL31420819 0.86 ALDH1A1 (0.39) ALDH1A1GFERMEN1KMT2ATDP1
SCHEMBL2084230 0.84 ALDH1A1 (0.48) ALDH1A1GFERHTTNPSR1MEN1
SCHEMBL6172065 0.82 GPR119 (0.35) ALDH1A1TDP1
SCHEMBL27746941 0.82 CYP2C9 (0.47) TDP1NAMPT
SCHEMBL28861530 0.82 CPB2 (0.45) ALDH1A1GFERHTTNPSR1MEN1
SCHEMBL14468493 0.81 NPC1 (0.33) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL2328448 0.81 ALDH1A1 (0.44) ALDH1A1GFERHTTNPSR1TDP1
SCHEMBL2470563 0.80 NR1H2 (0.38) ALDH1A1MEN1KMT2ATDP1
SCHEMBL2219479 0.80 NR1H2 (0.38) TDP1
SCHEMBL18950459 0.79 GPR119 (0.36) HTTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8557989-B2 Electrochemical affinity biosensor system and methods ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2013-10-15 US disclosed
US-20130213822-A1 ELECTROCHEMICAL AFFINITY BIOSENSOR SYSTEM AND METHODS ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2013-08-22 US disclosed
US-8293904-B2 Electrochemical affinity biosensor system and methods ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2012-10-23 US disclosed
US-8288544-B2 Electrochemical affinity biosensor system and methods ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2012-10-16 US disclosed
EP-1646637-B1 ELECTROCHEMICAL AFFINITY BIOSENSOR SYSTEM AND METHODS ROCHE DIAGNOSTICS GMBH (DE) 2012-08-15 EP disclosed
EP-1646637-B1 ELECTROCHEMICAL AFFINITY BIOSENSOR SYSTEM AND METHODS ROCHE DIAGNOSTICS GMBH (DE) 2012-08-15 EP disclosed
EP-2465862-A1 Mononuclear osmium complexes for use in biosensors Roche Diagniostics GmbH (DE) 2012-06-20 EP disclosed
EP-2465862-A1 Mononuclear osmium complexes for use in biosensors Roche Diagniostics GmbH (DE) 2012-06-20 EP disclosed
US-20120125788-A1 ELECTROCHEMICAL AFFINITY BIOSENSOR SYSTEM AND METHODS ROCHE DIAGNOSTICS OPERATIONS, INC. 2012-05-24 US disclosed
WO-2011088075-A2 NOVEL SALTS, POLYMORPHS, AND SYNTHETIC PROCESSES REGARDING IMIDAZOLE DERIVATIVE ORE PHARMACEUTICALS INC. (US) 2011-07-21 WO disclosed
WO-2005026178-A2 ELECTROCHEMICAL AFFINITY BIOSENSOR SYSTEM AND METHODS ROCHE DIAGNOSTICS GMBH (DE) 2005-03-24 WO disclosed
WO-2001017992-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-03-15 WO disclosed
CN-1039323-C Imidazopyriding derivatives and process for preparation thereof TANABE SEIYAKU CO (JP) 1998-07-29 CN disclosed
EP-0531876-B1 Imidazoindolizine derivatives and process for preparation thereof TANABE SEIYAKU CO (JP) 1996-12-18 EP disclosed
US-5510354-A HYPOTENSIVE AGENTS TANABE SEIYAKU CO., LTD. (JP) 1996-04-23 US disclosed
US-5424316-A Imidazopyridine derivatives for the treatment of hypertension TANABE SEIYAKU CO., LTD. (JP) 1995-06-13 US disclosed
US-5409936-A Useful in prophylaxix; exhibits potent angiotensin ii inhibitory acivities TANABE SEIYAKU CO., LTD. (JP) 1995-04-25 US disclosed
US-5268377-A Imidazoindolizine derivatives process for preparation thereof and use thereof to treat hypertension TANABE SEIYAKU CO., LTD. (JP) 1993-12-07 US disclosed
EP-0531876-A2 Imidazoindolizine derivatives and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1993-03-17 EP disclosed
EP-0531874-A1 Imidazopyridine derivatives and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1993-03-17 EP 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-20130213822-A1 ELECTROCHEMICAL AFFINITY BIOSENSOR SYSTEM AND METHODS SIGLEC7, FCGR3B, FCER2 ALDH1A1 1343/4885GFER 1404/4885HTT 4827/4885
US-20120125788-A1 ELECTROCHEMICAL AFFINITY BIOSENSOR SYSTEM AND METHODS SIGLEC7, FCGR3B, FCER2 ALDH1A1 1343/4885GFER 1404/4885HTT 4827/4885

“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.