SCHEMBL3403399

SCHEMBL3403399

CC(C)(C)OC(=O)c1cc(C(=O)O)cc(C(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 3/20 0.43
SLC7A5 Q01650 1/20 0.43
CA12 O43570 4/20 0.42
CA1 P00915 4/20 0.42
CA2 P00918 4/20 0.42
CA9 Q16790 4/20 0.42
CA14 Q9ULX7 4/20 0.42
CA7 P43166 3/20 0.41
CA3 P07451 2/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
PKM P14618 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA2 P47869 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL6577887 1.00 TPMT (0.43) TPMTSLC7A5CA12CA1CA2
SCHEMBL25708271 0.92 TPMT (0.57) TPMTSLC7A5CA12CA1CA2
SCHEMBL20894429 0.92 KDM4E (0.47) TPMTSLC7A5CA12CA1CA2
SCHEMBL7058435 0.91 CA12 (0.47) SLC7A5CA12CA1CA2CA9
SCHEMBL5093115 0.91 NOTUM (0.42) TPMTSLC7A5CA12CA1CA2
SCHEMBL20928667 0.91 SLC7A5 (0.38) TPMTSLC7A5CA12CA1CA2
SCHEMBL21015932 0.88 SLC7A5 (0.40) TPMTSLC7A5CA12CA1CA2
SCHEMBL5272199 0.85 SMN1; SMN2 (0.48) TPMTMAPTALDH1A1TDP1TP53
SCHEMBL9049724 0.85 SMN1; SMN2 (0.48) TPMTMAPTALDH1A1TDP1TP53
SCHEMBL30163785 0.84 SLC7A5 (0.56) SLC7A5CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4452930-A1 IONIZABLE AMINE AND ESTER LIPIDS AND LIPID NANOPARTICLES Beam Therapeutics Inc. (US) 2024-10-30 EP disclosed
US-20240335543-A1 IONIZABLE AMINE AND ESTER LIPIDS AND LIPID NANOPARTICLES BEAM THERAPEUTICS INC. 2024-10-10 US disclosed
WO-2023121970-A1 IONIZABLE AMINE AND ESTER LIPIDS AND LIPID NANOPARTICLES BEAM THERAPEUTICS INC. (US) 2023-06-29 WO disclosed
WO-2023121970-A1 IONIZABLE AMINE AND ESTER LIPIDS AND LIPID NANOPARTICLES BEAM THERAPEUTICS INC. (US) 2023-06-29 WO disclosed
US-11180523-B2 Design, synthesis and use of synthetic nucleotides comprising charge mass tags QUANTUMDX GROUP LIMITED (GB) 2021-11-23 US disclosed
US-10759824-B2 Design, synthesis and use of synthetic nucleotides comprising charge mass tags QUANTUMDX GROUP LIMITED (GB) 2020-09-01 US disclosed
US-20190248827-A1 DESIGN, SYNTHESIS AND USE OF SYNTHETIC NUCLEOTIDES COMPRISING CHARGE MASS TAGS QUANTUMDX GROUP LIMITED (GB) 2019-08-15 US disclosed
US-20190151403-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. 2019-05-23 US disclosed
US-10273261-B2 Design, synthesis and use of synthetic nucleotides comprising charge mass tags QUANTUMDX GROUP LIMITED (GB) 2019-04-30 US disclosed
US-20190004055-A1 DESIGN, SYNTHESIS AND USE OF SYNTHETIC NUCLEOTIDES COMPRISING CHARGE MASS TAGS QUANTUMDX GROUP LIMITED (GB) 2019-01-03 US disclosed
US-20160139133-A1 DESIGN, SYNTHESIS AND USE OF SYNTHETIC NUCLEOTIDES COMPRISING CHARGE MASS TAGS QUANTUMDX GROUP LIMITED (GB) 2016-05-19 US disclosed
EP-2239565-B1 OPTICAL-ISOMER SEPARATING AGENT FOR CHROMATOGRAPHY AND PROCESS FOR PRODUCING THE SAME UNIV OKAYAMA NAT UNIV CORP (JP) 2014-08-27 EP disclosed
US-8562863-B2 Cholesteric glassy liquid crystals with hybrid chiral-nematic mesogens THE UNIVERSITY OF ROCHESTER (US) 2013-10-22 US disclosed
US-8562863-B2 Cholesteric glassy liquid crystals with hybrid chiral-nematic mesogens THE UNIVERSITY OF ROCHESTER (US) 2013-10-22 US disclosed
US-8362237-B2 Optical-isomer separating agent for chromatography and process for producing the same NATIONAL UNIVERSITY CORPORATION OKAYAMA UNIVERSITY (JP) 2013-01-29 US disclosed
US-8362237-B2 Optical-isomer separating agent for chromatography and process for producing the same NATIONAL UNIVERSITY CORPORATION OKAYAMA UNIVERSITY (JP) 2013-01-29 US disclosed
US-20100292464-A1 OPTICAL-ISOMER SEPARATING AGENT FOR CHROMATOGRAPHY AND PROCESS FOR PRODUCING THE SAME DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-11-18 US disclosed
US-20100292464-A1 OPTICAL-ISOMER SEPARATING AGENT FOR CHROMATOGRAPHY AND PROCESS FOR PRODUCING THE SAME DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-11-18 US disclosed
EP-2239565-A1 OPTICAL-ISOMER SEPARATING AGENT FOR CHROMATOGRAPHY AND PROCESS FOR PRODUCING THE SAME National University Corporation Okayama University (JP) 2010-10-13 EP disclosed
US-20100086704-A1 CHOLESTERIC GLASSY LIQUID CRYSTALS WITH HYBRID CHIRAL-NEMATIC MESOGENS THE UNIVERSITY OF ROCHESTER 2010-04-08 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 (8 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-11180523-B2 Design, synthesis and use of synthetic nucleotides comprising charge mass tags POLM, RNGTT, TYMP TPMT 392/4885SLC7A5 421/4885CA12 3749/4885
US-20190151403-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF MALT1, MYLK2, FKBP1B TPMT 122/4885SLC7A5 2750/4885CA12 2159/4885
US-20190004055-A1 DESIGN, SYNTHESIS AND USE OF SYNTHETIC NUCLEOTIDES COMPRISING CHARGE MASS TAGS POLM, RNGTT, TYMP TPMT 392/4885SLC7A5 421/4885CA12 3749/4885
US-10759824-B2 Design, synthesis and use of synthetic nucleotides comprising charge mass tags POLM, RNGTT, TYMP TPMT 392/4885SLC7A5 421/4885CA12 3749/4885
US-20190248827-A1 DESIGN, SYNTHESIS AND USE OF SYNTHETIC NUCLEOTIDES COMPRISING CHARGE MASS TAGS POLM, RNGTT, TYMP TPMT 392/4885SLC7A5 421/4885CA12 3749/4885
US-20240335543-A1 IONIZABLE AMINE AND ESTER LIPIDS AND LIPID NANOPARTICLES PHOSPHO1, SGMS1, SGMS2 TPMT 4451/4885SLC7A5 171/4885CA12 711/4885
US-10273261-B2 Design, synthesis and use of synthetic nucleotides comprising charge mass tags POLM, RNGTT, TYMP TPMT 392/4885SLC7A5 421/4885CA12 3749/4885
US-20100292464-A1 OPTICAL-ISOMER SEPARATING AGENT FOR CHROMATOGRAPHY AND PROCESS FOR PRODUCING THE SAME ORC3, OXER1, HCCS TPMT 4270/4885SLC7A5 1481/4885CA12 511/4885

“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.