SCHEMBL3689674

SCHEMBL3689674

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 1/20 0.44
▸ NSD2 O96028 1/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ PAX8 Q06710 1/20 0.44
▸ CA2 P00918 2/20 0.42
▸ CA1 P00915 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ PTGS1 P23219 4/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ TYR P14679 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ELANE P08246 3/20 0.37
▸ PTGS2 P35354 2/20 0.36
▸ CTSG P08311 1/20 0.35
▸ GABBR2 O75899 1/20 0.34
▸ GABBR1 Q9UBS5 1/20 0.34

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
SCHEMBL3698561 0.95 TDP2 (0.44) TDP2NSD2HSP90AA1PAX8CA2
SCHEMBL3692504 0.91 TDP2 (0.39) TDP2NSD2HSP90AA1PAX8CA2
SCHEMBL3705362 0.85 PTPN1 (0.41) TDP2NSD2HSP90AA1PAX8CA2
SCHEMBL3705368 0.84 CA2 (0.48) CA2CA1PTPN1CYP1A2CYP2C9
SCHEMBL3699478 0.84 PTPN1 (0.51) CA2CA1PTPN1CYP1A2CYP2C9
SCHEMBL3692462 0.82 PTPN1 (0.41) TDP2NSD2HSP90AA1PAX8CA2
SCHEMBL3688310 0.80 CA2 (0.50) CA2CA1PTPN1CYP1A2CYP2C9
SCHEMBL3694663 0.80 CA2 (0.46) CA2CA1PTPN1CYP1A2CYP2C9
SCHEMBL3695064 0.78 PTPN1 (0.51) CA2CA1PTPN1CYP1A2CYP2C9
SCHEMBL3691403 0.78 PTPN1 (0.47) CA2CA1PTPN1CYP1A2CYP2C9

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 24 patents — showing the first 20. 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
EP-1325154-A2 METHOD FOR THE DETECTION OF CYTOSINE METHYLATIONS Epigenomics AG (DE) 2003-07-09 — — EP claimed
EP-1294945-A2 METHOD FOR DETECTING CYTOSINE METHYLATIONS Epigenomics AG (DE) 2003-03-26 — — EP claimed
WO-2002031186-A2 METHOD FOR THE DETECTION OF CYTOSINE METHYLATIONS EPIGENOMICS AG (DE) 2002-04-18 — — WO claimed
WO-2001098528-A2 METHOD FOR DETECTING CYTOSINE METHYLATIONS EPIGENOMICS AG (DE) 2001-12-27 — — WO 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
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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