SCHEMBL4246903

SCHEMBL4246903

O=C(O)c1cc(C(=O)O)cc(-c2ccc(-c3cc(-c4ccc(-c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc(-c4ccc(-c5cc(C(=O)O)cc(C(=O)O)c5)cc4)c3)cc2)c1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 6/20 0.67
KMO O15229 1/20 0.58
EGFR P00533 1/20 0.57
RXRA P19793 5/20 0.56
RXRB P28702 4/20 0.56
BCL2L1 Q07817 1/20 0.50
BAD Q92934 1/20 0.50
CYCS P99999 1/20 0.50
RXRG P48443 1/20 0.50

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
SCHEMBL18604547 1.00 DHODH (0.67) DHODHKMOEGFRRXRARXRB
SCHEMBL15814719 0.97 DHODH (0.69) DHODHKMOEGFRRXRARXRB
SCHEMBL16488615 0.97 DHODH (0.69) DHODHKMOEGFRRXRARXRB
SCHEMBL23346266 0.95 EGFR (0.64) DHODHKMOEGFRRXRARXRB
SCHEMBL686581 0.92 RXRA (0.65) DHODHEGFRRXRARXRBBCL2L1
SCHEMBL15120764 0.92 EGFR (0.67) DHODHKMOEGFRRXRARXRB
SCHEMBL12203147 0.92 DHODH (0.57) DHODHKMOEGFRRXRARXRB
SCHEMBL15521765 0.92 DHODH (0.57) DHODHKMOEGFRRXRARXRB
Water SCHEMBL28916522 0.90 RXRA (0.63) DHODHEGFRRXRARXRBBCL2L1
SCHEMBL28462472 0.90 DHODH (0.75) DHODHKMOEGFRRXRARXRB

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210230191-A1 FORMATION OF METAL-ORGANIC FRAMEWORKS TRUSTEES OF DARTMOUTH COLLEGE (US) 2021-07-29 US claimed
US-20240424488-A1 High-Entropy Metal-Organic Frameworks NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC 2024-12-26 US disclosed
EP-4422792-A1 MULTIPLEXED TARGETED AMPLIFICATION OF POLYNUCLEOTIDES Singular Genomics Systems, Inc. (US) 2024-09-04 EP disclosed
WO-2023172665-A2 NUCLEIC ACID DELIVERY SCAFFOLDS Singular Genomics Systems, Inc. (US) 2023-09-14 WO disclosed
WO-2023076833-A1 MULTIPLEXED TARGETED AMPLIFICATION OF POLYNUCLEOTIDES Singular Genomics Systems, Inc. (US) 2023-05-04 WO disclosed
US-11077327-B1 Degradation of chemical agents using metal-organic framework compositions NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2021-08-03 US disclosed
US-20210231628-A1 PHOTOLUMINESCENCE-BASED DETECTION OF ACID GASES VIA RARE EARTH METAL-ORGANIC FRAMEWORKS NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC 2021-07-29 US disclosed
US-11007516-B1 Tunable metal-organic framework compositions and methods thereof NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2021-05-18 US disclosed
US-9132411-B2 Strategies, linkers and coordination polymers for high-performance sorbents THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2015-09-15 US disclosed
US-8841471-B2 Open metal organic frameworks with exceptional surface area and high gas storage capacity THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-09-23 US disclosed
US-20130237411-A1 Novel Strategies, Linkers and Coordination Polymers for High-Performance Sorbents THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-09-12 US disclosed
US-8383545-B2 Strategies, linkers and coordination polymers for high-performance sorbents THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-02-26 US disclosed
US-20120172612-A1 OPEN METAL ORGANIC FRAMEWORKS WITH EXCEPTIONAL SURFACE AREA AND HIGH GAS STORAGE CAPACITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-07-05 US disclosed
US-20090062498-A1 NOVEL STRATEGIES, LINKERS AND COORDINATION POLYMERS FOR HIGH-PERFORMANCE SORBENTS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-03-05 US disclosed
WO-2009029838-A1 NOVEL STRATEGIES, LINKERS AND COORDINATION POLYMERS FOR HIGH-PERFORMANCE SORBENTS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-03-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130237411-A1 Novel Strategies, Linkers and Coordination Polymers for High-Performance Sorbents ILK, TIMCC, EPCAM DHODH 3619/4885KMO 2256/4885EGFR 1901/4885
US-20120172612-A1 OPEN METAL ORGANIC FRAMEWORKS WITH EXCEPTIONAL SURFACE AREA AND HIGH GAS STORAGE CAPACITY EPCAM, SLCO1A2, SLCO2A1 DHODH 2987/4885KMO 2173/4885EGFR 1702/4885
US-20090062498-A1 NOVEL STRATEGIES, LINKERS AND COORDINATION POLYMERS FOR HIGH-PERFORMANCE SORBENTS ILK, TIMCC, EPCAM DHODH 3619/4885KMO 2256/4885EGFR 1901/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.