SCHEMBL4675922

SCHEMBL4675922

CCC(=O)OC(C)(C)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.41
TSHR P16473 3/20 0.35
MGAM O43451 2/20 0.32
GAA P10253 2/20 0.32
SI P14410 2/20 0.32
MGAM2 Q2M2H8 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TP53 P04637 1/20 0.32
RAB9A P51151 1/20 0.32
TET2 Q6N021 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
CA14 Q9ULX7 1/20 0.31
NAAA Q02083 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL24160913 0.83 ALDH1A1 (0.44) DGAT1TSHRALDH1A1LMNACA12
SCHEMBL26296844 0.81 DGAT1 (0.38) DGAT1TSHRKMT2A
SCHEMBL4678703 0.80 CYP4F2 (0.43) TSHRMGAMGAASIMGAM2
SCHEMBL7814548 0.80 DGAT1 (0.40) DGAT1TSHRMGAMGAASI
SCHEMBL26292497 0.80 DGAT1 (0.40) DGAT1TSHRMGAMGAASI
SCHEMBL7062820 0.78 LMNA (0.38) TSHRALDH1A1LMNAKMT2ASMN1; SMN2
SCHEMBL23334609 0.77 PRKCA (0.35) KMT2ARECQL
SCHEMBL23293937 0.77 NAAA (0.39) TSHRALDH1A1RAB9ALMNANAAA
SCHEMBL23334447 0.77 NAAA (0.31) TSHRNAAA
SCHEMBL24943260 0.77 DGKA (0.48) TSHRALDH1A1LMNANAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220274909-A1 METHOD FOR PRODUCING ALPHA-ACYLOXYCARBOXYLIC ACID ESTER MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2022-09-01 US disclosed
EP-4001257-A1 METHOD FOR PRODUCING A-ACYLOXY CARBOXYLIC ACID ESTER MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2022-05-25 EP disclosed
EP-3816268-A1 ISOBUTYRIC ESTER COMPOUND HAVING PROPANOYLOXY GROUP AT ? POSITION, PERFUME COMPOSITION, AND USE AS PERFUME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-05-05 EP disclosed
EP-3816268-A1 ISOBUTYRIC ESTER COMPOUND HAVING PROPANOYLOXY GROUP AT ? POSITION, PERFUME COMPOSITION, AND USE AS PERFUME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-05-05 EP disclosed
CN-112334568-A Isobutyrate compounds having propionyloxy group at alpha position, fragrance compositions and use as fragrance 三菱瓦斯化学株式会社 2021-02-05 CN disclosed
US-8212050-B2 Amidine compounds and herbicides NIPPON SODA CO., LTD. (JP) 2012-07-03 US disclosed
US-20110301355-A1 Amidine compounds and herbicides NIPPON SODA CO., LTD. (JP) 2011-12-08 US disclosed
EP-1095935-B1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL CO (JP) 2008-12-17 EP disclosed
EP-1911350-A1 AMIDINE COMPOUND AND HERBICIDE NIPPON SODA CO., LTD. (JP) 2008-04-16 EP disclosed
EP-1101761-B1 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL CO (JP) 2005-08-17 EP disclosed
US-20030216258-A1 Condensed heterocylic compounds and herbicides containing them as active ingredients SUMITOMO CHEMICAL COMPANY, LIMITED 2003-11-20 US disclosed
US-6586368-B1 Benzofuran derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-07-01 US disclosed
US-6410484-B1 ACTIVE MATERIAL; CONTROLLING WEEDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-25 US disclosed
US-6339155-B1 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-15 US disclosed
EP-1101761-A2 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-23 EP disclosed
EP-1095935-A1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-02 EP 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-20220274909-A1 METHOD FOR PRODUCING ALPHA-ACYLOXYCARBOXYLIC ACID ESTER ACACA, PCCA, APEH DGAT1 629/4885TSHR 859/4885MGAM 2531/4885
US-20110301355-A1 Amidine compounds and herbicides DDT, GATD3, PAM DGAT1 2678/4885TSHR 1305/4885MGAM 701/4885
US-20030216258-A1 Condensed heterocylic compounds and herbicides containing them as active ingredients CBR3, CBR1, HAAO DGAT1 1300/4885TSHR 1858/4885MGAM 2073/4885

“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.