SCHEMBL811863

SCHEMBL811863

CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)C(F)C(=O)C(F)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 8/20 0.55
CASP7 P55210 6/20 0.51
CASP1 P29466 5/20 0.51
CASP9 P55211 3/20 0.51
ELANE P08246 1/20 0.49
CASP4 P49662 2/20 0.48
REN P00797 1/20 0.48
CTSK P43235 4/20 0.47
CTSB P07858 3/20 0.47
CASP10 Q92851 2/20 0.47
CASP8 Q14790 1/20 0.47

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
SCHEMBL28840715 1.00 CASP3 (0.55) CASP3CASP7CASP1CASP9ELANE
SCHEMBL20543505 0.96 CASP3 (0.58) CASP3CASP7CASP1CASP9CASP4
SCHEMBL1264575 0.89 CASP3 (0.55) CASP3CASP7CASP1CASP9ELANE
SCHEMBL614741 0.89 CASP3 (0.62) CASP3CASP7CASP1CASP9ELANE
SCHEMBL3140616 0.89 CASP3 (0.62) CASP3CASP7CASP1CASP9ELANE
SCHEMBL29409608 0.88 CASP3 (0.55) CASP3CASP7CASP1CASP9ELANE
SCHEMBL18740358 0.88 CASP3 (0.58) CASP3CASP7CASP1CASP9ELANE
SCHEMBL24213871 0.87 CASP3 (0.56) CASP3CASP7CASP1CASP9CASP8
SCHEMBL17494194 0.87 CASP3 (0.56) CASP3CASP7CASP1CASP9CASP8
SCHEMBL7112627 0.87 CASP3 (0.58) CASP3CASP7CASP1CASP9ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8652844-B2 Methods for the cryopreservation of animal cells that contain high levels of intracellular lipids THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2014-02-18 US claimed
US-20100190248-A1 Methods for the Cryopreservation of Animal Cells that Contain High Levels of Intracellular Lipids THE CURATORS OF THE UNIVERSITY OF MISSOURI 2010-07-29 US claimed
US-20090232866-A1 Oligopeptides as coating material for medical products HEMOTEQ AG (DE) 2009-09-17 US claimed
WO-2007146253-A2 METHODS FOR THE CRYOPRESERVATION OF ANIMAL CELLS THAT CONTAIN HIGH LEVELS OF INTRACELLULAR LIPIDS CRITSER JOHN K (US) 2007-12-21 WO claimed
JP-2007507264-A 2007-03-29 JP claimed
EP-1670502-A2 OLIGOPEPTIDES AS COATING MATERIAL FOR MEDICAL PRODUCTS Hemoteq GmbH (DE) 2006-06-21 EP claimed
WO-2005039629-A2 CASPASE INHIBITORS AS COATING MATERIEL FOR MEDICAL PRODUCTS FOR INHIBITING RESTENOSIS HEMOTEQ GMBH (DE) 2005-05-06 WO claimed
CN-115551536-A Caspase inhibitors for enhanced wound repair and treatment of bacterial and viral infections 约翰斯·霍普金斯大学 2022-12-30 CN disclosed
CN-114057777-B Beta-carboline derivative and preparation method and application thereof 南方海洋科学与工程广东省实验室(湛江) 2022-12-02 CN disclosed
CN-114057777-A Beta-carboline derivative and preparation method and application thereof 南方海洋科学与工程广东省实验室(湛江) 2022-02-18 CN disclosed
EP-3242723-B1 USE OF HINOKITIOL FOR RESTORING PHYSIOLOGY IN IRON-DEFICIENT ORGANISMS UNIV ILLINOIS (US) 2021-10-06 EP disclosed
US-10842843-B2 Augmenting the immune response by promoting cell death of immune cells THE UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE (US) 2020-11-24 US disclosed
US-10456441-B2 Augmenting the immune response by promoting cell death of immune cells THE UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE (US) 2019-10-29 US disclosed
US-20030108551-A1 Methods and compositions of monoclonal antibodies specific for beta-amyloid proteins DIAGENICS INTERNATIONAL CORPORATION 2003-06-12 US disclosed
EP-1124842-B1 BETULINIC ACID DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROECTODERMAL TUMORS DEUTSCHES KREBSFORSCH (DE) 2003-05-28 EP disclosed
WO-2003039467-A2 MONOCLONAL ANTIBODIES SPECIFIC FOR BETA-AMYLOID. DIAGENICS INTERNATIONAL CORPORATION (US) 2003-05-15 WO disclosed
WO-2002074346-A2 TARGETING CHEMICAL COMPOUNDS TO CELLS NST NEUROSURVIVAL TECHNOLOGIES LTD. (IL) 2002-09-26 WO disclosed
US-6369109-B1 Betulinic acid and derivatives thereof useful for the treatment of neuroectodermal tumor DEUTSCHES KREBSFORSCHUNGSZENTRUM STIFTUNG DES OFFENTLICHEN RECHTS (DE) 2002-04-09 US disclosed
EP-1124842-A1 BETULINIC ACID AND DERIVATIVES THEREOF USEFUL FOR THE TREATMENT OF NEUROECTODERMAL TUMORS Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2001-08-22 EP disclosed
WO-2000024762-A1 BETULINIC ACID AND DERIVATIVES THEREOF USEFUL FOR THE TREATMENT OF NEUROECTODERMAL TUMORS Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2000-05-04 WO disclosed