SCHEMBL232652

SCHEMBL232652

COOc1c[nH]c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 2/20 0.56
ATM Q13315 1/20 0.50
NR4A2 P43354 1/20 0.47
CREBBP Q92793 1/20 0.47
PBRM1 Q86U86 1/20 0.47
GPR84 Q9NQS5 3/20 0.44
CYP3A4 P08684 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
AHR P35869 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HTR2A P28223 3/20 0.43
HTR2C P28335 3/20 0.43
HTR2B P41595 2/20 0.43
HTR1D P28221 2/20 0.43
HTR1B P28222 2/20 0.43
HTR7 P34969 2/20 0.43
HTR6 P50406 2/20 0.43
ADRB1 P08588 1/20 0.43

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
SCHEMBL6535531 0.87 SLC22A6 (0.58) SLC22A6ATMNR4A2CREBBPPBRM1
SCHEMBL1899742 0.83 SLC22A6 (0.59) SLC22A6ATMNR4A2CREBBPPBRM1
SCHEMBL3538344 0.79 SLC22A6 (0.58) SLC22A6ATMNR4A2CREBBPPBRM1
SCHEMBL31378042 0.76 SLC22A6 (0.61) SLC22A6ATMNR4A2CREBBPPBRM1
SCHEMBL28374800 0.75 SLC22A6 (0.55) SLC22A6ATMNR4A2CREBBPPBRM1
SCHEMBL28459212 0.75 SLC22A6 (0.59) SLC22A6ATMNR4A2CREBBPPBRM1
SCHEMBL28961088 0.75 SLC22A6 (0.55) SLC22A6ATMNR4A2PBRM1GPR84
SCHEMBL1198963 0.74 SLC22A6 (0.54) SLC22A6ATMNR4A2CREBBPPBRM1
SCHEMBL5229462 0.74 SLC22A6 (0.54) SLC22A6ATMGPR84CYP3A4MEN1
SCHEMBL21965348 0.74 SLC22A6 (0.54) SLC22A6ATMNR4A2CREBBPPBRM1

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
EP-3494093-B1 METHODS AND USES OF DISSOLVED ORGANIC MATERIAL FRACTIONS FOR BINDING METAL IONS NOBLEGEN INC (CA) 2022-05-18 EP claimed
US-10773978-B2 Methods and uses of dissolved organic material fractions for binding metal ions Noblegen, Inc. (CA) 2020-09-15 US claimed
US-20190210898-A1 METHODS AND USES OF DISSOLVED ORGANIC MATERIAL FRACTIONS FOR BINDING METAL IONS TRENT UNIVERSITY (CA) 2019-07-11 US claimed
EP-3494093-A1 METHODS AND USES OF DISSOLVED ORGANIC MATERIAL FRACTIONS FOR BINDING METAL IONS Noblegen Inc. (CA) 2019-06-12 EP claimed
US-11440822-B2 Methods and uses of dissolved organic material fractions for binding metal ions Noblegen, Inc. (CA) 2022-09-13 US disclosed
EP-3494093-B1 METHODS AND USES OF DISSOLVED ORGANIC MATERIAL FRACTIONS FOR BINDING METAL IONS NOBLEGEN INC (CA) 2022-05-18 EP disclosed
US-20220128556-A1 METHODS OF DIAGNOSING DISEASE 4D Pharma Cork Limited (IE) 2022-04-28 US disclosed
CN-114040986-A Method of diagnosing disease 4D制药科克有限公司 2022-02-11 CN disclosed
EP-3947743-A1 METHODS OF DIAGNOSING DISEASE 4D Pharma Cork Limited (IE) 2022-02-09 EP disclosed
US-20200407252-A1 METHODS AND USES OF DISSOLVED ORGANIC MATERIAL FRACTIONS FOR BINDING METAL IONS TRENT UNIVERSITY (CA) 2020-12-31 US disclosed
WO-2020201457-A1 METHODS OF DIAGNOSING DISEASE 4D Pharma Cork Limited (IE) 2020-10-08 WO disclosed
US-10773978-B2 Methods and uses of dissolved organic material fractions for binding metal ions Noblegen, Inc. (CA) 2020-09-15 US disclosed
US-20190210898-A1 METHODS AND USES OF DISSOLVED ORGANIC MATERIAL FRACTIONS FOR BINDING METAL IONS TRENT UNIVERSITY (CA) 2019-07-11 US disclosed
EP-3494093-A1 METHODS AND USES OF DISSOLVED ORGANIC MATERIAL FRACTIONS FOR BINDING METAL IONS Noblegen Inc. (CA) 2019-06-12 EP disclosed
US-9673030-B2 Computer readable storage mediums, methods and systems for normalizing chemical profiles in biological or medical samples detected by mass spectrometry EMORY UNIVERSITY (US) 2017-06-06 US disclosed
EP-2279417-B1 METABOLIC BIOMARKERS FOR OVARIAN CANCER AND METHODS OF USE THEREOF GEORGIA TECH RES INST (US) 2016-07-20 EP disclosed
US-20120004854-A1 METABOLIC BIOMARKERS FOR OVARIAN CANCER AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION 2012-01-05 US disclosed
US-20110282587-A1 COMPUTER READABLE STORAGE MEDIUMS, METHODS AND SYSTEMS FOR NORMALIZING CHEMICAL PROFILES IN BIOLOGICAL OR MEDICAL SAMPLES DETECTED BY MASS SPECTROMETRY EMORY UNIVERSITY (US) 2011-11-17 US disclosed
EP-2279417-A1 METABOLIC BIOMARKERS FOR OVARIAN CANCER AND METHODS OF USE THEREOF Georgia Tech Research Corporation (US) 2011-02-02 EP disclosed
WO-2009151967-A1 METABOLIC BIOMARKERS FOR OVARIAN CANCER AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2009-12-17 WO disclosed