SCHEMBL5199644

SCHEMBL5199644

OC(Oc1ccccc1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.53
LTA4H P09960 5/20 0.50
TSHR P16473 1/20 0.50
NR1H2 P55055 1/20 0.50
BAX Q07812 1/20 0.50
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
MAOA P21397 1/20 0.45
ACACB O00763 1/20 0.42
ACACA Q13085 1/20 0.42
PARP10 Q53GL7 1/20 0.42

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
SCHEMBL194418 0.87 SLC6A4 (0.41) SRD5A2LTA4HTSHR
SCHEMBL16093381 0.82 LTA4H (0.54) SRD5A2LTA4HTSHRNR1H2BAX
SCHEMBL21133961 0.80 SRD5A2 (0.75) SRD5A2LTA4HTSHRNR1H2BAX
SCHEMBL477692 0.78 SRD5A2 (0.72) SRD5A2LTA4HTSHRNR1H2BAX
SCHEMBL2954812 0.78 SLC6A4 (0.49) SRD5A2PPARGPPARA
SCHEMBL10773234 0.78 SLC6A4 (0.49) PPARGPPARA
SCHEMBL10489380 0.78 LMNA (0.34) SRD5A2LTA4HTSHRNR1H2BAX
SCHEMBL10854458 0.78 ACP3 (0.53) LTA4HPPARGPPARACA1CA2
SCHEMBL4368301 0.77 SRD5A2 (0.55) SRD5A2LTA4HTSHRNR1H2BAX
SCHEMBL1253750 0.77 SRD5A2 (0.55) SRD5A2LTA4HTSHRNR1H2BAX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1400599-B1 Mass label linked hybridisation probes XZILLION GMBH & CO KG (DE) 2007-10-03 EP disclosed
EP-0979305-B1 MASS LABEL LINKED HYBRIDISATION PROBES XZILLION GMBH & CO KG (DE) 2006-09-27 EP disclosed
US-20050042625-A1 Mass label linked hybridisation probes XZILLION GMBH & CO. (DE) 2005-02-24 US disclosed
EP-1400599-A1 Mass label linked hybridisation probes Xzillion GmbH & CO.KG (DE) 2004-03-24 EP disclosed
US-6699668-B1 FOR DETERMINING HYBRIDIZATION BY CLEAVING THE LABEL FROM THE HYBRIDIZED PROBE, WHERE EACH MASS LABEL IS RELATABLE TO THE PROBE'S BASE SEQUENCE BY MASS SPECTROMETRY XZILLION GMBH & CO. (DE) 2004-03-02 US disclosed
EP-1095052-A1 SILICON-CONTAINING LINKERS FOR NUCLEIC ACID MASS MARKERS Brax Group Limited (GB) 2001-05-02 EP disclosed
EP-0979305-A1 MASS LABEL LINKED HYBRIDISATION PROBES Brax Group Limited (GB) 2000-02-16 EP disclosed
WO-2000002894-A1 SILICON-CONTAINING LINKERS FOR NUCLEIC ACID MASS MARKERS BRAX GROUP LIMITED (GB) 2000-01-20 WO disclosed
WO-1998031830-A1 MASS LABEL LINKED HYBRIDISATION PROBES BRAX GROUP LIMITED (GB) 1998-07-23 WO disclosed