SCHEMBL5152473

SCHEMBL5152473

OCCc1cccc2c(Br)c3ccccc3c(Br)c12

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
APOBEC3G Q9HC16 1/20 0.31
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
HSPA5 P11021 1/20 0.30
CHEK1 O14757 1/20 0.30
ACP3 P15309 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
SCHEMBL2309169 0.78 ALDH1A1 (0.41) TDP1ALDH1A1TSHRHTTAPOBEC3G
SCHEMBL4355034 0.76 ALDH1A1 (0.46) TDP1ALDH1A1TSHRHTT
SCHEMBL2309762 0.76 ALDH1A1 (0.40) TDP1ALDH1A1TSHRHTTAPOBEC3G
SCHEMBL11315591 0.73 TDP1 (0.42) TDP1GABRA1GABRB2ALDH1A1TSHR
SCHEMBL16415013 0.71 TAAR1 (0.38) TDP1GABRA1GABRB2TAAR1
SCHEMBL27550 0.70 CYP1A2 (0.54) TDP1HTTACP3
SCHEMBL22288310 0.70 TAAR1 (0.40) TDP1GABRA1GABRB2ALDH1A1TAAR1
SCHEMBL29534868 0.70 TDP1 (0.55) TDP1ALDH1A1TSHRHTTAPOBEC3G
SCHEMBL31203 0.70 TDP1 (0.55) TDP1ALDH1A1TSHRHTTAPOBEC3G
SCHEMBL23043093 0.69 HTR2A (0.40) TDP1ALDH1A1TSHRTAAR1CHEK1

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
EP-0984281-B1 A homogeneous assay for determining analyte DADE BEHRING MARBURG GMBH (DE) 2007-01-03 EP disclosed
EP-1418430-A2 A homogeneous assay for determining analyte Dade Behring Marburg GmbH (DE) 2004-05-12 EP disclosed
EP-0984282-B1 Particles having an incorporated composition comprising a chemiluminescent compound DADE BEHRING MARBURG GMBH (DE) 2003-07-30 EP disclosed
US-6406913-B1 ANALYZING A SAMPLE, TREATING WITH ENERGY AND DETECTION A SIGNAL DADE BEHRING MARBURG GMBH (DE) 2002-06-18 US disclosed
EP-0515194-B1 Assay methods utilizing induced luminescence DADE BEHRING MARBURG GMBH (DE) 2001-10-31 EP disclosed
US-6251581-B1 MIXTURE OF SUSPENDABLE PARTICLES, ONE TYPE IS CHEMILUMINESCENT COMPOUND CAPABLE OF REACTING WITH SINGLET OXYGEN, THE OTHER TYPE IS PHOTOSENSITIZER WHICH IS CAPABLE OF ACTIVATING OXYGEN TO ITS SINGLET STATE DADE BEHRING MARBURG GMBH (DE) 2001-06-26 US disclosed
EP-0984281-A2 A homogeneous assay for determining analyte Dade Behring Marburg GmbH (DE) 2000-03-08 EP disclosed
EP-0984282-A2 Particles having an incorporated composition comprising a chemiluminescent compound Dade Behring Marburg GmbH (DE) 2000-03-08 EP disclosed
EP-0716746-B1 FLUORESCENT OXYGEN CHANNELING IMMUNOASSAYS BEHRINGWERKE AG (DE) 1999-03-17 EP disclosed
US-5807675-A PHOTOSENSITIZER; GENERATING FREE RADICALS; MEASURING LIGHT BEHRINGWERKE AG (DE) 1998-09-15 US disclosed
US-5616719-A Photoactive indicator compounds BEHRINGWERKE AG (DE) 1997-04-01 US disclosed
EP-0716746-A1 FLUORESCENT OXYGEN CHANNELING IMMUNOASSAYS BEHRINGWERKE AG (DE) 1996-06-19 EP disclosed
WO-1995006877-A1 FLUORESCENT OXYGEN CHANNELING IMMUNOASSAYS BEHRINGWERKE AG (DE) 1995-03-09 WO disclosed
EP-0515194-A2 Assay methods utilizing induced luminescence BEHRINGWERKE Aktiengesellschaft (DE) 1992-11-25 EP disclosed