SCHEMBL15524271

SCHEMBL15524271

O=C(O)c1ccc(C#Cc2ccc(C(=O)O)c(O)c2)cc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 2/20 0.61
ALDH1A1 P00352 6/20 0.59
CA12 O43570 3/20 0.59
CA1 P00915 3/20 0.59
CA2 P00918 3/20 0.59
CA7 P43166 3/20 0.59
CA9 Q16790 3/20 0.59
CA14 Q9ULX7 3/20 0.59
TSHR P16473 1/20 0.59
KDM4E B2RXH2 5/20 0.55
MAPT P10636 2/20 0.55
PTPN1 P18031 2/20 0.55
CYP3A4 P08684 1/20 0.55
GAA P10253 1/20 0.55
ESR2 Q92731 1/20 0.55
ACMSD Q8TDX5 1/20 0.52
XDH P47989 1/20 0.49
SLC22A12 Q96S37 1/20 0.49
HPGD P15428 4/20 0.47
HSD17B10 Q99714 3/20 0.47

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
SCHEMBL15941312 0.92 HNF4A (0.74) HNF4AALDH1A1CA12CA1CA2
SCHEMBL15524796 0.92 ALDH1A1 (0.55) HNF4AALDH1A1CA12CA1CA2
SCHEMBL15631831 0.86 CA12 (0.57) HNF4AALDH1A1CA12CA1CA2
SCHEMBL7605479 0.84 ALDH1A1 (0.47) HNF4AALDH1A1CA12CA1CA2
SCHEMBL7615611 0.83 ALDH1A1 (0.55) HNF4AALDH1A1CA12CA1CA2
SCHEMBL4962858 0.83 XDH (0.68) ALDH1A1CA12CA1CA2CA7
SCHEMBL20503723 0.82 HNF4A (0.60) HNF4AALDH1A1CA12CA1CA2
SCHEMBL21679889 0.82 HNF4A (0.60) HNF4AALDH1A1CA12CA1CA2
SCHEMBL27178395 0.80 HNF4A (0.63) HNF4AALDH1A1CA12CA1CA2
SCHEMBL19342932 0.80 RARB (0.68) CYP3A4

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-11426714-B2 Metal organic frameworks (MOFs) and methods of synthesizing and using the same VIETNAM NATIONAL UNIVERSITY HO CHI MINH CITY (VN) 2022-08-30 US claimed
US-20210162388-A1 METAL ORGANIC FRAMEWORKS (MOFs) AND METHODS OF SYNTHESIZING AND USING THE SAME Center for Innovative Materials and Architectures (VN) 2021-06-03 US claimed
US-11426714-B2 Metal organic frameworks (MOFs) and methods of synthesizing and using the same VIETNAM NATIONAL UNIVERSITY HO CHI MINH CITY (VN) 2022-08-30 US disclosed
US-20210162388-A1 METAL ORGANIC FRAMEWORKS (MOFs) AND METHODS OF SYNTHESIZING AND USING THE SAME Center for Innovative Materials and Architectures (VN) 2021-06-03 US disclosed
US-20210162388-A1 METAL ORGANIC FRAMEWORKS (MOFs) AND METHODS OF SYNTHESIZING AND USING THE SAME Center for Innovative Materials and Architectures (VN) 2021-06-03 US disclosed
US-9139600-B2 Acetylene bridged linkers and metal-organic frameworks (MOFs) produced thereof BASF SE (DE) 2015-09-22 US disclosed
US-9139600-B2 Acetylene bridged linkers and metal-organic frameworks (MOFs) produced thereof BASF SE (DE) 2015-09-22 US disclosed
US-9139600-B2 Acetylene bridged linkers and metal-organic frameworks (MOFs) produced thereof BASF SE (DE) 2015-09-22 US disclosed
EP-2897929-A1 ACETYLENE BRIDGED LINKERS AND METAL-ORGANIC FRAMEWORKS (MOFS) PRODUCED THEREOF BASF SE (DE) 2015-07-29 EP disclosed
CN-104797548-A Acetylene bridging linkers and Metal Organic Frameworks (MOFs) prepared therefrom BASF SE 2015-07-22 CN disclosed
WO-2014045135-A1 ACETYLENE BRIDGED LINKERS AND METAL-ORGANIC FRAMEWORKS (MOFS) PRODUCED THEREOF BASF SE (DE) 2014-03-27 WO disclosed
WO-2014045135-A1 ACETYLENE BRIDGED LINKERS AND METAL-ORGANIC FRAMEWORKS (MOFS) PRODUCED THEREOF BASF SE (DE) 2014-03-27 WO disclosed
US-20140081044-A1 Acetylene Bridged Linkers and Metal-Organic Frameworks (MOFs) Produced Thereof BASF SE (DE) 2014-03-20 US disclosed
US-20140081044-A1 Acetylene Bridged Linkers and Metal-Organic Frameworks (MOFs) Produced Thereof BASF SE (DE) 2014-03-20 US disclosed
US-20140081044-A1 Acetylene Bridged Linkers and Metal-Organic Frameworks (MOFs) Produced Thereof BASF SE (DE) 2014-03-20 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 (1 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-20140081044-A1 Acetylene Bridged Linkers and Metal-Organic Frameworks (MOFs) Produced Thereof B3GNT2, KAT8, MDH2 HNF4A 2426/4885ALDH1A1 1647/4885CA12 28/4885

“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.