SCHEMBL4572037

SCHEMBL4572037

CSCC[C@H](C)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
SCHEMBL12518152 1.00
SCHEMBL8044370 1.00
SCHEMBL5139179 0.81 GABRR1 (0.72)
SCHEMBL18504425 0.80
SCHEMBL15107342 0.80
SCHEMBL3916347 0.80
SCHEMBL13594467 0.80
SCHEMBL3916344 0.80
SCHEMBL4956698 0.79 RNPEP (0.62)
SCHEMBL10028544 0.78

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240209029-A1 ADIPONECTIN GLYCOPEPTIDES AND COMPOSITIONS AND METHODS OF USE THEREOF THE UNIVERSITY OF HONG KONG (CN) 2024-06-27 US disclosed
US-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-07-13 US disclosed
US-9777024-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners, LLC (US) 2017-10-03 US disclosed
US-20170043020-A1 ANTIBODY-MEDIATED DISRUPTION OF QUORUM SENSING IN BACTERIA NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-02-16 US disclosed
US-20170001948-A1 DIAMINE CROSSLINKING AGENTS, CROSSLINKED ACIDIC POLYSACCHARIDES AND MEDICAL MATERIALS SEIKAGAKU CORPORATION (JP) 2017-01-05 US disclosed
US-20160137672-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2016-05-19 US disclosed
US-9221843-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners, LLC (US) 2015-12-29 US disclosed
US-9078880-B2 Cytoprotective agent NATIONAL UNIVERSITY CORPORATION TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY (JP) 2015-07-14 US disclosed
US-9078880-B2 Cytoprotective agent NATIONAL UNIVERSITY CORPORATION TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY (JP) 2015-07-14 US disclosed
US-20150119362-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2015-04-30 US disclosed
WO-2014066659-A9 HETEROARYL INHIBITORS OF PDE4 TETRA DISCOVERY PARTNERS, LLC. (US) 2015-02-12 WO disclosed
US-8470763-B2 Alpha-amino-N-substituted amides, pharmaceutical composition containing them and uses thereof SHANGHAI INSTITUTE OF MATERIA MEDICA CHINESE ACADEMY OF SCIENCES (CN) 2013-06-25 US disclosed
US-8466291-B2 1,5-dideoxy-1,5-imino-D-glucitol compounds ACADEMIA SINICA (TW) 2013-06-18 US disclosed
US-20130040917-A1 Phenazopyridine Compounds PINNACLE PHARMACEUTICALS, INC. (US) 2013-02-14 US disclosed
US-8288365-B2 Phenazopyridine compounds PINNACLE PHARMACEUTICALS, INC. (US) 2012-10-16 US disclosed
US-20120135996-A1 CYTOPROTECTIVE AGENT CORXEL PHARMACEUTICALS HONG KONG LIMITED (CN) 2012-05-31 US disclosed
US-20120135996-A1 CYTOPROTECTIVE AGENT CORXEL PHARMACEUTICALS HONG KONG LIMITED (CN) 2012-05-31 US disclosed
EP-2452679-A1 CYTOPROTECTIVE AGENT National University Corporation Tokyo University Of Agriculture and Technology (JP) 2012-05-16 EP disclosed
US-20110319367-A1 Phenazopyridine Compounds PINNACLE PHARMACEUTICALS, INC. (US) 2011-12-29 US disclosed
US-20110021624-A1 Alpha-Amino-N-Substituted Amides, Pharmaceutical Composition Containing Them and Uses Thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2011-01-27 US disclosed