SCHEMBL2214151

SCHEMBL2214151

O=C1C=CC(=Nc2ccc(O)cc2)C=C1c1c(Cl)cccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TXNRD1 Q16881 1/20 0.38
▸ TXNRD3 Q86VQ6 1/20 0.38
▸ TXNRD2 Q9NNW7 1/20 0.38
▸ MAPT P10636 2/20 0.33
▸ THRB P10828 2/20 0.33
▸ BLM P54132 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ BRCA1 P38398 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL7593065 0.78 MAOA (0.50) MAPTTHRBMEN1ALDH1A1LMNA
SCHEMBL11119934 0.77 TXNRD1 (0.41) TXNRD1TXNRD3TXNRD2MAPTTHRB
2,6-Dichlorophenol SCHEMBL1030875 0.75 TXNRD1 (0.63) TXNRD1TXNRD3TXNRD2MAPTTHRB
2,6-Dichlorophenol SCHEMBL5320190 0.74 TXNRD1 (0.61) TXNRD1TXNRD3TXNRD2MAPTTHRB
SCHEMBL7744841 0.72 CA12 (0.35) TXNRD1TXNRD3TXNRD2MAPTTHRB
SCHEMBL8976573 0.71 MAOA (0.50) MAPTTHRBBLMMEN1USP2
SCHEMBL1046225 0.70 TXNRD1 (0.53) TXNRD1TXNRD3TXNRD2MAPTTHRB
SCHEMBL4886981 0.68 TXNRD1 (0.57) TXNRD1TXNRD3TXNRD2MAPTMEN1
SCHEMBL9755674 0.68 TXNRD1 (0.35) TXNRD1TXNRD3TXNRD2MAPTMEN1
SCHEMBL35153 0.66 TXNRD1 (0.58) TXNRD1TXNRD3TXNRD2MAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4141792-A ENZYMATIC COLORIMETRIC ANALYSIS HAYASHI HIROAKI 1979-02-27 — — US claimed
JP-58063850-A — — None — — JP disclosed
US-20180245121-A1 ELECTROCHEMICAL BIOSENSOR THE UNIVERSITY OF QUEENSLAND (AU) 2018-08-30 — — US disclosed
EP-3303574-A1 ELECTROCHEMICAL BIOSENSOR The University Of Queensland (AU) 2018-04-11 — — EP disclosed
WO-2016191812-A1 ELECTROCHEMICAL BIOSENSOR THE UNIVERSITY OF QUEENSLAND (AU) 2016-12-08 — — WO disclosed
EP-1470242-B1 ENZYMATIC CYCLING ASSAYS FOR HOMOCYSTEINE AND CYSTATHIONINE AXIS SHIELD DIAGNOSTICS LTD (GB) 2013-08-14 — — EP disclosed
EP-1230381-B1 ENZYMATIC CYCLING ASSAYS FOR HOMOCYSTEINE AND CYSTATHIONINE AXIS SHIELD DIAGNOSTICS LTD (GB) 2011-07-27 — — EP disclosed
US-6867014-B2 Enzymatic cycling assays for homocysteine and cystathionine CATCH, INC. 2005-03-15 — — US disclosed
EP-1470242-A2 ENZYMATIC CYCLING ASSAYS FOR HOMOCYSTEINE AND CYSTATHIONINE Catch, Inc. (US) 2004-10-27 — — EP disclosed
EP-1230381-A4 ENZYMATIC CYCLING ASSAYS FOR HOMOCYSTEINE AND CYSTATHIONINE CATCH INC (US) 2004-10-13 — — EP disclosed
US-20040096929-A1 Enzymatic cycling assays for homocysteine and cystathionine AXIS-SHIELD DIAGNOSTICS, LTD. (GB) 2004-05-20 — — US disclosed
US-6664073-B1 Contacting with cystathionine beta-synthase, L-serine, and cystathionine beta-lyase to catalyze the cyclical conversion of homocysteine to cystathionine and the reconversion of cystathionine to homocysteine; pyruvate and NH3 CATCH INC. 2003-12-16 — — US disclosed
US-6635438-B2 Beta-synthase, L-serine, cystathionine beta-lyase; amount of pyruvate and/or ammonia produced from reconversion of cystathionine to homocysteine; improvement comprises completing the enzymatic conversion in less than 15 minutes CATCH, INC. 2003-10-21 — — US disclosed
US-20030138872-A1 Enzymatic cycling assays for homocysteine and cystathionine AXIS-SHIELD DIAGNOSTICS, LTD. (GB) 2003-07-24 — — US disclosed
WO-2003040694-A2 ENZYMATIC CYCLING ASSAYS FOR HOMOCYSTEINE AND CYSTATHIONINE CATCH, INC. (US) 2003-05-15 — — WO disclosed
EP-1230381-A2 ENZYMATIC CYCLING ASSAYS FOR HOMOCYSTEINE AND CYSTATHIONINE Catch, Inc. (US) 2002-08-14 — — EP disclosed
WO-2001033187-A2 ENZYMATIC CYCLING ASSAYS FOR HOMOCYSTEINE AND CYSTATHIONINE CATCH, INC. (US) 2001-05-10 — — WO disclosed
US-4481292-A COMPLEXING WITH TRIS BUFFER THE COCA-COLA COMPANY (US) 1984-11-06 — — US disclosed
JP-S5863850-A TEST PAPER FOR QUALITATIVE DETERMINATION OF ASCORBIC ACID KANKYO BUNSEKI CENTER:KK 1983-04-15 — — JP disclosed
US-4141792-A ENZYMATIC COLORIMETRIC ANALYSIS HAYASHI HIROAKI 1979-02-27 — — US disclosed
Send feedback