SCHEMBL1646347

SCHEMBL1646347

O=C(CC(O)C(=O)Oc1ncc[nH]1)Oc1ncc[nH]1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL7571795 0.80 ALDH1A1 (0.37) KDM4EALDH1A1NPC1RAB9A
SCHEMBL4060537 0.78 TBXAS1 (0.39) KDM4EALDH1A1NPC1RAB9A
SCHEMBL7545549 0.77 MMP1 (0.32) KDM4EALDH1A1
SCHEMBL3734749 0.77 ALDH1A1 (0.38) KDM4EALDH1A1NPC1RAB9A
SCHEMBL25475176 0.75 TBXAS1 (0.33) KDM4EALDH1A1NPC1RAB9A
SCHEMBL16859466 0.75 TBXAS1 (0.33) KDM4EALDH1A1NPC1RAB9A
SCHEMBL11048265 0.75 TBXAS1 (0.33) KDM4EALDH1A1NPC1RAB9A
SCHEMBL16859463 0.75 TBXAS1 (0.33) KDM4EALDH1A1NPC1RAB9A
SCHEMBL1487897 0.75 ELANE (0.42) KDM4EALDH1A1NPC1RAB9A
SCHEMBL11589157 0.75 TBXAS1 (0.44) KDM4EALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114980932-A SORTILIN-binding conjugate compounds, compositions thereof, and their use for treating cancer 瑟瑞技术公司 2022-08-30 CN claimed
CN-114980932-A SORTILIN-binding conjugate compounds, compositions thereof, and their use for treating cancer 瑟瑞技术公司 2022-08-30 CN disclosed
WO-2011049836-A1 ANTIBODY HEAVY CHAIN VARIABLE REGION (VH) DOMAIN EXCHANGE THE SCRIPPS RESEARCH INSTITUTE (US) 2011-04-28 WO disclosed
US-20110091992-A1 CRYSTALS AND STRUCTURE OF HUMAN IgG Fc VARIANT MEDIMMUNE, LLC (US) 2011-04-21 US disclosed
EP-2078091-A2 CRYSTALS AND STRUCTURE OF HUMAN IgG Fc VARIANT Medimmune, LLC (US) 2009-07-15 EP disclosed
WO-2009009103-A2 CRYSTALS AND STRUCTURE OF HUMAN IgG Fc VARIANT MEDIMMUNE, LLC (US) 2009-01-15 WO disclosed
EP-1627046-A4 DOMAIN-EXCHANGED BINDING MOLECULES, METHODS OF USE AND METHODS OF PRODUCTION SCRIPPS RESEARCH INST (US) 2008-02-13 EP disclosed
US-7200493-B2 Method for screening crystallization or amorphous stage conditions for molecules CHEMICAL HOLOVOICE AB (SE) 2007-04-03 US disclosed
EP-1627046-A2 DOMAIN-EXCHANGED BINDING MOLECULES, METHODS OF USE AND METHODS OF PRODUCTION The Scripps Research Institute (US) 2006-02-22 EP disclosed
US-20050003347-A1 Domain-exchanged binding molecules, methods of use and methods of production NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-01-06 US disclosed
WO-2004101738-A2 DOMAIN-EXCHANGED BINDING MOLECULES, METHODS OF USE AND METHODS OF PRODUCTION THE SCRIPPS RESEARCH INSTITUTE (US) 2004-11-25 WO disclosed
EP-1360349-A1 SYSTEM AND METHOD FOR SCREENING OF NUCLEATION TENDENCY OF A MOLECULE IN A LEVITATED DROPLET Chemical Holovoice AB (SE) 2003-11-12 EP disclosed
US-20030049642-A1 Screening system NILSSON STAFFAN (SE) 2003-03-13 US disclosed
WO-2002057520-A1 SYSTEM AND METHOD FOR SCREENING OF NUCLEATION TENDENCY OF A MOLECULE IN A LEVITATED DROPLET CHEMICAL HOLOVOICE AB (SE) 2002-07-25 WO disclosed