SCHEMBL3692504

SCHEMBL3692504

Cc1ccc2c(c1C)C(=O)C(O)=C(c1cc(Br)c(O)c(C(C)(C)C)c1)C2=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 1/20 0.39
▸ NSD2 O96028 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ PAX8 Q06710 1/20 0.39
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ PTPN1 P18031 1/20 0.36
▸ CA2 P00918 2/20 0.34
▸ CA1 P00915 1/20 0.34
▸ ELANE P08246 4/20 0.33
▸ PTGS1 P23219 3/20 0.32
▸ IGF1R P08069 1/20 0.32
▸ CISD1 Q9NZ45 1/20 0.32
▸ CTSG P08311 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.30
▸ POLB P06746 1/20 0.30
▸ TYR P14679 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ PTGS2 P35354 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
SCHEMBL3689674 0.91 TDP2 (0.44) TDP2NSD2HSP90AA1PAX8CYP1A2
SCHEMBL3698561 0.86 TDP2 (0.44) TDP2NSD2HSP90AA1PAX8CYP1A2
SCHEMBL3705362 0.77 PTPN1 (0.41) TDP2NSD2HSP90AA1PAX8CYP1A2
SCHEMBL3705368 0.76 CA2 (0.48) CYP1A2CYP2C9CYP2C19PTPN1CA2
SCHEMBL3699478 0.76 PTPN1 (0.51) CYP1A2CYP2C9CYP2C19PTPN1CA2
SCHEMBL3692462 0.75 PTPN1 (0.41) TDP2NSD2HSP90AA1PAX8CYP1A2
SCHEMBL3688310 0.72 CA2 (0.50) CYP1A2CYP2C9CYP2C19PTPN1CA2
SCHEMBL3694663 0.72 CA2 (0.46) CYP1A2CYP2C9CYP2C19PTPN1CA2
SCHEMBL6835172 0.71 ELANE (0.37) TDP2NSD2HSP90AA1PAX8CYP1A2
SCHEMBL3695064 0.71 PTPN1 (0.51) CYP1A2CYP2C9CYP2C19PTPN1CA2

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-8241855-B2 Method for detecting cytosine methylations EPIGENOMICS AG (DE) 2012-08-14 — — US claimed
EP-1325154-B1 METHOD FOR THE DETECTION OF CYTOSINE METHYLATIONS EPIGENOMICS AG (DE) 2007-08-01 — — EP claimed
US-7118868-B2 Method for detecting cytosine methylations EPIGENOMICS AG (DE) 2006-10-10 — — US claimed
EP-1707642-A2 Method for detecting cytosine methylations Epigenomics AG (DE) 2006-10-04 — — EP claimed
EP-1294945-B1 METHOD FOR DETECTING CYTOSINE METHYLATIONS EPIGENOMICS AG (DE) 2006-08-30 — — EP claimed
US-20040152080-A1 Method for detecting cytosine methylations QIAGEN GMBH (DE) 2004-08-05 — — US claimed
US-8377638-B2 Process for the detection of cytosine methylations QIAGEN GMBH (DE) 2013-02-19 — — US disclosed
US-8241855-B2 Method for detecting cytosine methylations EPIGENOMICS AG (DE) 2012-08-14 — — US disclosed
US-20100297614-A1 PROCESS FOR THE DETECTION OF CYTOSINE METHYLATIONS QIAGEN GMBH (DE) 2010-11-25 — — US disclosed
EP-1977011-B1 PROCESS FOR THE DETECTION OF CYTOSINE METHYLATIONS QIAGEN GMBH (DE) 2010-07-28 — — EP disclosed
EP-1977011-A1 PROCESS FOR THE DETECTION OF CYTOSINE METHYLATIONS Qiagen GmbH (DE) 2008-10-08 — — EP disclosed
US-20070207472-A1 Method for detecting cytosine methylations QIAGEN GMBH (DE) 2007-09-06 — — US disclosed
EP-1325154-B1 METHOD FOR THE DETECTION OF CYTOSINE METHYLATIONS EPIGENOMICS AG (DE) 2007-08-01 — — EP disclosed
WO-2007077262-A1 PROCESS FOR THE DETECTION OF CYTOSINE METHYLATIONS QIAGEN GMBH (DE) 2007-07-12 — — WO disclosed
US-7118868-B2 Method for detecting cytosine methylations EPIGENOMICS AG (DE) 2006-10-10 — — US disclosed
EP-1707642-A2 Method for detecting cytosine methylations Epigenomics AG (DE) 2006-10-04 — — EP disclosed
EP-1294945-B1 METHOD FOR DETECTING CYTOSINE METHYLATIONS EPIGENOMICS AG (DE) 2006-08-30 — — EP disclosed
US-20040152080-A1 Method for detecting cytosine methylations QIAGEN GMBH (DE) 2004-08-05 — — US disclosed
EP-1294945-A2 METHOD FOR DETECTING CYTOSINE METHYLATIONS Epigenomics AG (DE) 2003-03-26 — — EP disclosed
WO-2001098528-A2 METHOD FOR DETECTING CYTOSINE METHYLATIONS EPIGENOMICS AG (DE) 2001-12-27 — — WO disclosed
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