SCHEMBL163745

SCHEMBL163745

O=C(c1ccccc1)c1ccc(O)c(C(=O)O)c1C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 3/20 0.59
GAA P10253 2/20 0.55
MEN1 O00255 1/20 0.55
USP2 O75604 1/20 0.55
KMT2A Q03164 1/20 0.55
KEAP1 Q14145 1/20 0.55
NFE2L2 Q16236 1/20 0.55
KDM4E B2RXH2 1/20 0.50
LMNA P02545 2/20 0.49
HTT P42858 2/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
ALDH1A1 P00352 2/20 0.48

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
SCHEMBL27617414 0.87 AKR1C3 (0.57) AKR1C3GAAMEN1USP2KMT2A
SCHEMBL809324 0.86 AKR1C3 (0.72) AKR1C3GAAMEN1USP2KMT2A
SCHEMBL1647825 0.85 AKR1C3 (0.64) AKR1C3GAAMEN1USP2KMT2A
SCHEMBL6056938 0.84 AKR1C3 (0.69) AKR1C3GAAMEN1USP2KMT2A
SCHEMBL6057040 0.84 AKR1C3 (0.69) AKR1C3GAAMEN1USP2KMT2A
SCHEMBL22939141 0.83 HPGD (0.55) AKR1C3MEN1KMT2AKDM4ELMNA
SCHEMBL28318689 0.82 GAA (0.56) AKR1C3GAAMEN1USP2KMT2A
SCHEMBL78196 0.82 GAA (0.56) AKR1C3GAAMEN1USP2KMT2A
SCHEMBL29557032 0.82 GAA (0.56) AKR1C3GAAMEN1USP2KMT2A
SCHEMBL8935427 0.81 ALDH1A1 (0.65) AKR1C3GAAMEN1USP2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240199653-A1 METHOD FOR FORMING AN ELECTRICALLY CONDUCTIVE METAL ORGANIC FRAMEWORK COMPOSITE KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2024-06-20 US claimed
WO-2024123903-A1 SORBENT COMPOSITIONS, SYSTEMS, AND METHODS GE INFRASTRUCTURE TECHNOLOGY LLC (US) 2024-06-13 WO claimed
EP-3801880-A1 METHOD FOR IN-SITU SYNTHESIS OF METAL ORGANIC FRAMEWORKS (MOFS), COVALENT ORGANIC FRAMEWORKS (COFS) AND ZEOLITE IMIDAZOLATE FRAMEWORKS (ZIFS), AND APPLICATIONS THEREOF Desiccant Rotors International Private Ltd. (IN) 2021-04-14 EP claimed
US-20210016245-A1 METHOD FOR IN-SITU SYNTHESIS OF METAL ORGANIC FRAMEWORKS (MOFs), COVALENT ORGANIC FRAMEWORKS (COFs) AND ZEOLITE IMIDAZOLATE FRAMEWORKS (ZIFs), AND APPLICATIONS THEREOF DESICCANT ROTORS INTERNATIONAL PRIVATE LIMITED (IN) 2021-01-21 US claimed
US-20200291045-A1 CONDUCTIVITY ENHANCEMENT OF MOFS VIA DEVELOPMENT OF MOFPOLYMER COMPOSITE MATERIAL KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2020-09-17 US claimed
US-20240197868-A1 IMMUNOGENIC COMPOSITION CONTAINING AN ANTIGEN AND AN ADJUVANT COMPRISING AL-MOFS UNIVERSITE DE VERSAILLES-SAINT-QUENTIN-EN-YVELINES (FR) 2024-06-20 US disclosed
US-20240199653-A1 METHOD FOR FORMING AN ELECTRICALLY CONDUCTIVE METAL ORGANIC FRAMEWORK COMPOSITE KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2024-06-20 US disclosed
WO-2024123909-A1 SORBENT COMPOSITIONS, SYSTEMS, AND METHODS GE INFRASTRUCTURE TECHNOLOGY LLC (US) 2024-06-13 WO disclosed
WO-2024123903-A1 SORBENT COMPOSITIONS, SYSTEMS, AND METHODS GE INFRASTRUCTURE TECHNOLOGY LLC (US) 2024-06-13 WO disclosed
EP-4313133-A2 IMMUNOGENIC COMPOSITION CONTAINING AN ANTIGEN AND AN ADJUVANT COMPRISING AL-MOFS UNIVERSITE DE VERSAILLES-SAINT QUENTIN EN YVELINES (FR) 2024-02-07 EP disclosed
US-11891406-B2 Conductivity enhancement of MOFs via development of MOFpolymer composite material KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2024-02-06 US disclosed
US-11767331-B2 Water stable zinc-based metal organic framework and method of use KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2023-09-26 US disclosed
US-20100076220-A1 NOVEL METAL ORGANIC FRAMEWORKS BASED ON ALUMINUM, IRON AND CHROMIUM BASF SE (DE) 2010-03-25 US disclosed
US-20090306420-A1 PROCESS FOR PREPARING COPPER-COMPRISING METAL ORGANIC FRAMEWORKS BASF SE (DE) 2009-12-10 US disclosed
US-20090281341-A1 METAL-ORGANIC ZIRCONIUM-BASED FRAMEWORK MATERIALS BASF SE (DE) 2009-11-12 US disclosed
US-20090198079-A1 PROCESS FOR PREPARING METAL ORGANIC FRAMEWORKS COMPRISING METALS OF TRANSITION GROUP IV BASF SE 2009-08-06 US disclosed
US-20090171107-A1 PROCESS FOR PREPARING POROUS METAL ORGANIC FRAMEWORKS BASF SE (DE) 2009-07-02 US disclosed
US-20080300387-A1 Organometallic Framework Materials of Transition Group III BASF SE (DE) 2008-12-04 US disclosed
US-20080281116-A1 Acid-Functionalized Organometallic Framework Materials BASF SE (DE) 2008-11-13 US disclosed
US-20080227634-A1 porous metal-organic framework material for taking up at least one substance, the framework material comprising at least one at least bidentate organic compound bound by coordination to at least one metal ion, and the framework material having at least in part pores which comprise a polymer BASF SE (DE) 2008-09-18 US 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 (2 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-20090171107-A1 PROCESS FOR PREPARING POROUS METAL ORGANIC FRAMEWORKS OSTC, OGDH, SCO2 AKR1C3 168/4885GAA 4308/4885MEN1 2489/4885
US-20090306420-A1 PROCESS FOR PREPARING COPPER-COMPRISING METAL ORGANIC FRAMEWORKS AOC1, AOC2, AOC3 AKR1C3 167/4885GAA 2574/4885MEN1 975/4885

“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.