SCHEMBL3703368

SCHEMBL3703368

CCSC1=C(c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)C(=O)c2ccc(C)cc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.49
▸ ESR2 Q92731 5/20 0.49
▸ PTGS1 P23219 6/20 0.41
▸ PTGS2 P35354 4/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ MAP2K7 O14733 1/20 0.40
▸ S100A4 P26447 1/20 0.40
▸ CDC25A P30304 1/20 0.40
▸ CDC25B P30305 1/20 0.40
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ CA2 P00918 2/20 0.37
▸ CA1 P00915 1/20 0.37
▸ ELANE P08246 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TYR P14679 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ LCK P06239 1/20 0.36
▸ ALKBH3 Q96Q83 1/20 0.35

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
SCHEMBL3699283 0.81 PTPN1 (0.47) ESR1ESR2PTGS1PTGS2PTPN1
SCHEMBL3691403 0.81 PTPN1 (0.47) ESR1ESR2PTGS1PTGS2PTPN1
SCHEMBL3692363 0.80 PTPN1 (0.45) ESR1ESR2PTGS1PTGS2PTPN1
SCHEMBL3694365 0.77 PTPN1 (0.46) PTGS1PTGS2PTPN1MAP2K7CDC25A
SCHEMBL3694406 0.77 PTPN1 (0.46) PTGS1PTGS2PTPN1MAP2K7CDC25A
SCHEMBL6735243 0.68 PTPN1 (0.51) ESR1ESR2PTGS1PTGS2PTPN1
SCHEMBL6730112 0.68 PTPN1 (0.57) PTGS1PTGS2PTPN1CA2CA1
SCHEMBL5570177 0.67 CA2 (0.55) PTGS1PTGS2PTPN1CA2CA1
SCHEMBL3695040 0.67 PTPN1 (0.62) PTGS1PTPN1CA2CA1ALDH1A1
SCHEMBL3688310 0.67 CA2 (0.50) PTGS1PTGS2PTPN1CA2CA1

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 21 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
WO-2002031186-A2 METHOD FOR THE DETECTION OF CYTOSINE METHYLATIONS EPIGENOMICS AG (DE) 2002-04-18 — — 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
US-20070207472-A1 Method for detecting cytosine methylations QIAGEN GMBH (DE) 2007-09-06 — — US 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
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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