SCHEMBL3206099

SCHEMBL3206099

COc1cc(C(=O)O)ccc1NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.52
FABP5 Q01469 1/20 0.49
PYGL P06737 4/20 0.47
KMT2A Q03164 3/20 0.46
RAB9A P51151 2/20 0.45
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA7 P43166 1/20 0.43
TPMT P51580 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
LTB4R Q15722 1/20 0.42
TTR P02766 1/20 0.42
CASP3 P42574 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL7927995 0.92 LTB4R (0.52) EPHX2FABP5KMT2ARAB9ALMNA
SCHEMBL14864718 0.90 KMT2A (0.46) EPHX2FABP5PYGLKMT2ARAB9A
SCHEMBL1251564 0.90 KMT2A (0.46) EPHX2FABP5PYGLKMT2ARAB9A
SCHEMBL3209189 0.88 EPHX2 (0.54) EPHX2FABP5KMT2ARAB9ACASP3
SCHEMBL25397265 0.88 EPHX2 (0.56) EPHX2FABP5KMT2ACASP3NPC1
SCHEMBL30522780 0.88 EPHX2 (0.56) EPHX2FABP5KMT2ACASP3NPC1
SCHEMBL29546978 0.86 EPHX2 (0.52) EPHX2FABP5KMT2ACASP3
SCHEMBL26628373 0.86 EPHX2 (0.52) EPHX2FABP5KMT2ACASP3
SCHEMBL29547060 0.86 EPHX2 (0.52) EPHX2FABP5KMT2ACASP3
SCHEMBL3214751 0.86 EPHX2 (0.57) EPHX2FABP5KMT2ACASP3

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 222 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9682123-B2 Methods of treating metabolic disease THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-06-20 US disclosed
US-20150190466-A1 METHODS OF TREATING METABOLIC DISEASE NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2015-07-09 US disclosed
US-20130160150-A1 METHODS FOR IDENTIFYING COMPOUNDS THAT MODULATE LISCH-LIKE PROTEIN OR C1ORF32 PROTEIN ACTIVITY AND METHODS OF USE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2013-06-20 US disclosed
US-8460880-B2 Compositions, splice variants and methods relating to ovarian specific genes and proteins DIADEXUS, INC. (US) 2013-06-11 US disclosed
US-7678889-B2 Compositions and methods relating to ovarian specific genes and proteins DIADEXUS, INC. (US) 2010-03-16 US disclosed
US-20090263411-A1 Compositions, splice variants and methods relating to ovarian specific genes and proteins DIAZYME LABORATORIES, INC. 2009-10-22 US disclosed
WO-2009076651-A9 METHODS FOR IDENTIFYING COMPOUNDS THAT MODULATE LISCH-LIKE PROTEIN OR C1ORF32 PROTEIN ACTIVITY AND METHODS OF USE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2009-08-27 WO disclosed
WO-2009076651-A2 METHODS FOR IDENTIFYING COMPOUNDS THAT MODULATE LISCH-LIKE PROTEIN OR C1ORF32 PROTEIN ACTIVITY AND METHODS OF USE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2009-06-18 WO disclosed
US-20090118175-A1 Compositions and Methods for Detection, Prognosis and Treatment of Breast Cancer MACINA ROBERTO A 2009-05-07 US disclosed
US-20080260761-A1 Compositions, Splice Variants and Methods Relating to Cancer Specific Genes and Proteins DIADEXUS, INC. 2008-10-23 US disclosed
WO-2002036807-A2 COMPOSITIONS AND METHODS RELATING TO BREAST SPECIFIC GENES AND PROTEINS DIADEXUS, INC. (US) 2002-05-10 WO disclosed
WO-2002036616-A2 COMPOSITIONS AND METHODS RELATING TO BREAST SPECIFIC GENES AND PROTEINS DIADEXUS, INC. (US) 2002-05-10 WO disclosed
US-20020048763-A1 Human genome-derived single exon nucleic acid probes useful for gene expression analysis AMERSHAM PLC (GB) 2002-04-25 US disclosed
US-20020048800-A1 Myosin-like gene expressed in human heart and muscle GE HEALTHCARE LIMITED (GB) 2002-04-25 US disclosed
WO-2002026818-A2 HUMAN NEDD-1 AEOMICA, INT. (US) 2002-04-04 WO disclosed
WO-2002024718-A1 COMPOSITIONS AND METHODS RELATING TO PROSTATE SPECIFIC GENES AND PROTEINS DIADEXUS, INC. (US) 2002-03-28 WO disclosed
WO-2002024750-A2 HUMAN KIDNEY TUMOR OVEREXPRESSED MEMBRANE PROTEIN 1 AEOMICA, INC. (US) 2002-03-28 WO disclosed
WO-2001092524-A2 MYOSIN-LIKE GENE EXPRESSED IN HUMAN HEART AND MUSCLE AEOMICA, INC. (US) 2001-12-06 WO disclosed
US-6326403-B1 CARDIOVASCULAR DISORDERS MERCK PATENT GESELLSCHAFT MIT (DE) 2001-12-04 US disclosed
CN-1309633-A Diacylhydrazine derivatives as integrin inhibitors MERCK PATENT GMBH (DE) 2001-08-22 CN disclosed