SCHEMBL10173048

SCHEMBL10173048

O=C1/C(=C2\Nc3ccc(Br)c(Cl)c3C2=O)Nc2ccc(Br)c(Cl)c21

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CES1 P23141 4/20 0.47
TGM2 P21980 2/20 0.32
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 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
SCHEMBL22711532 1.00 CES1 (0.47) CES1TGM2HTR2AHTR2CHTR2B
SCHEMBL6177499 0.85 CES1 (0.67) CES1TGM2
SCHEMBL31103242 0.85 CES1 (0.67) CES1TGM2
SCHEMBL11921526 0.72 CES1 (0.41) CES1TGM2
SCHEMBL31620681 0.68 HTR2A (0.33) CES1HTR2AHTR2CHTR2B
SCHEMBL13683268 0.68 CES1 (0.31) CES1
SCHEMBL22645637 0.67 HTR2A (0.35) CES1HTR2AHTR2CHTR2B
SCHEMBL23209053 0.64 MAPT (0.36) CES1TGM2
SCHEMBL734955 0.64 CES1 (1.00) CES1TGM2
SCHEMBL15463646 0.63 HTR2A (0.42) HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739305-B2 Sialyltransferase variants having neosialidase activity THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-08-29 US disclosed
US-20200325457-A1 SIALYL TRANSFERASE VARIANTS HAVING NEOSIALIDASE ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-10-15 US disclosed
US-10704070-B2 Protecting group chemistry for clean, reductant-free dyeing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-07-07 US disclosed
EP-2588144-B1 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MED SYST INC (US) 2018-05-09 EP disclosed
US-20160139143-A1 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MEDICAL SYSTEMS, INC. 2016-05-19 US disclosed
US-9291597-B2 Detecting targets using mass tags and mass spectrometry VENTANA MEDICAL SYSTEMS, INC. (US) 2016-03-22 US disclosed
US-20130122516-A1 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MEDICAL SYSTEMS, INC. 2013-05-16 US disclosed
WO-2012003478-A2 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MEDICAL SYSTEMS, INC. (US) 2012-01-05 WO disclosed
EP-2052084-B1 DRY FORMAT SIALIDASE ASSAY ALERE SWITZERLAND GMBH (CH) 2010-09-29 EP disclosed
WO-2010049450-A1 Non-hydrolytic microbial probes BIOSYNTH AG (CH) 2010-05-06 WO disclosed
WO-2008018074-A1 DRY FORMAT SIALIDASE ASSAY INVERNESS MEDICAL SWITZERLAND GMBH (CH) 2008-02-14 WO disclosed