SCHEMBL1989239

SCHEMBL1989239

CC(N)(C#N)C(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL7242661 1.00
SCHEMBL2166322 0.86 GRM2 (0.35)
SCHEMBL4353330 0.82
SCHEMBL13674735 0.80
SCHEMBL5836531 0.79
SCHEMBL28195894 0.76 ALDH1A1 (0.35)
SCHEMBL5165354 0.74
SCHEMBL5165359 0.74
SCHEMBL15083315 0.74
SCHEMBL28408720 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6630512-B2 Antiinflammatory agents; autoimmune disease BIOGEN, INC. 2003-10-07 US claimed
US-20240366738-A1 MOLECULAR VACCINES FOR INFECTIOUS DISEASE AGILENT TECHNOLOGIES INC (US) 2024-11-07 US disclosed
US-11992518-B2 Molecular vaccines for infectious disease AGILENT TECHNOLOGIES, INC. (US) 2024-05-28 US disclosed
US-10968269-B1 MHC multimers in borrelia diagnostics and disease AGILENT TECHNOLOGIES, INC. (US) 2021-04-06 US disclosed
US-20210047383-A1 MHC Multimers in Borrelia Diagnostics and Disease DAKO DENMARK APS (DK) 2021-02-18 US disclosed
US-20200347103-A1 MHC MULTIMERS IN TUBERCULOSIS DIAGNOSTICS, VACCINE AND THERAPEUTICS AGILENT TECHNOLOGIES INC (US) 2020-11-05 US disclosed
US-10611818-B2 MHC multimers in tuberculosis diagnostics, vaccine and therapeutics AGILENT TECHNOLOGIES, INC. (US) 2020-04-07 US disclosed
US-20190314471-A1 MOLECULAR VACCINES FOR INFECTIOUS DISEASE AGILENT TECHNOLOGIES, INC. 2019-10-17 US disclosed
US-10369204-B2 Molecular vaccines for infectious disease DAKO DENMARK A/S (DK) 2019-08-06 US disclosed
CN-105766927-B A kind of bactericidal composition and its application of the bacterium amine of pyrrole containing biphenyl and 2-cyano-3-amino-3-phenylancryic acetate 南京华洲药业有限公司 2018-04-20 CN disclosed
WO-2002070680-A1 METHOD OF IDENTIFYING INHIBITORS OF CDC25 BASF AKTIENGESELLSCHAFT (DE) 2002-09-12 WO disclosed
US-6429288-B1 OSTEOPOROSIS, OSTEOARTHRITIS, AND RHEUMATIC DISEASES ROCHE DIAGNOSTICS GMBH (DE) 2002-08-06 US disclosed
EP-1226237-A2 METHOD OF IDENTIFYING INHIBITORS OF CDC25 BASF AKTIENGESELLSCHAFT (DE) 2002-07-31 EP disclosed
US-20020068708-A1 OLIGONUCLEOTIDE ANALOGUES EXIQON A/S (DK) 2002-06-06 US disclosed
US-6242455-B1 INHIBITING A MATRIX METALLOPROTEASE ASSOCIATED DISEASE ROCHE DIAGNOSTICS GMBH (DE) 2001-06-05 US disclosed
WO-2001027077-A2 HYDROXYSULFONYLALKYLENE-, PHOSPHONOALKYLENE- OR DIFLUORO(PHOSPHONONON)METHYL- SUBSTITUTED BENZENE, OR BENZOFURAN DERIVATIVES AS NON-PEPTIDIC CDC25 INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-04-19 WO disclosed
WO-2001016300-A2 METHOD OF IDENTIFYING INHIBITORS OF CDC25 BASF AKTIENGESELLSCHAFT (DE) 2001-03-08 WO disclosed
EP-1009770-A1 PEPTIDES CONTAINING AN ARGININE MIMETIC FOR THE TREATMENT OF BONE METABOLIC DISORDERS, THEIR PRODUCTION, AND DRUGS CONTAINING THESE COMPOUNDS Roche Diagnostics GmbH (DE) 2000-06-21 EP disclosed
WO-1999012970-A1 PEPTIDES CONTAINING AN ARGININE MIMETIC FOR THE TREATMENT OF BONE METABOLIC DISORDERS, THEIR PRODUCTION, AND DRUGS CONTAINING THESE COMPOUNDS ROCHE DIAGNOSTICS GMBH (DE) 1999-03-18 WO disclosed
EP-0902036-A1 Peptide containing an arginine mimetic for the treatment of osteoporosis, their production, and drugs containing these compounds Roche Diagnostics GmbH (DE) 1999-03-17 EP disclosed