SCHEMBL6836069

SCHEMBL6836069

COC(=O)c1sc(C(=O)OC)c(OC)c1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.54
MAPT P10636 4/20 0.54
HSD17B10 Q99714 4/20 0.54
TSHR P16473 2/20 0.54
ALDH1A1 P00352 6/20 0.42
MEN1 O00255 2/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
HPGD P15428 4/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 4/20 0.39
GAA P10253 2/20 0.39
GLA P06280 1/20 0.39
ALOX15 P16050 1/20 0.39
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CISD2 Q8N5K1 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL9368306 0.87 ALDH1A1 (0.51) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL1848132 0.85 KDM4E (0.49) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL9368107 0.81 ALDH1A1 (0.46) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL2682770 0.79 MAPT (0.48) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL1844332 0.79 SMN1; SMN2 (0.57) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL31398801 0.78 MAPT (0.47) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL2761037 0.77 CA1 (0.39) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL2809243 0.77 MAPT (0.56) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL15210919 0.77 MAPT (0.56) KMT2AMAPTHSD17B10TSHRALDH1A1
SCHEMBL1086028 0.77 KMT2A (0.56) KMT2AMAPTHSD17B10TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107954976-B A method of synthesis 3,4- dimethoxy-thiophene 贝利化学(张家港)有限公司 2019-05-31 CN claimed
CN-107954976-A A kind of method of synthesis 3,4- dimethoxy-thiophenes 贝利化学(张家港)有限公司 2018-04-24 CN claimed
CN-110183465-A The preparation method of (2,3- dihydro-thiophene simultaneously [3,4-B] [1,4] dioxane hex- 2- yl) methanol 福建博鸿新能源科技有限公司 2019-08-30 CN disclosed
CN-107954976-B A method of synthesis 3,4- dimethoxy-thiophene 贝利化学(张家港)有限公司 2019-05-31 CN disclosed
CN-107954976-B A method of synthesis 3,4- dimethoxy-thiophene 贝利化学(张家港)有限公司 2019-05-31 CN disclosed
CN-107954976-A A kind of method of synthesis 3,4- dimethoxy-thiophenes 贝利化学(张家港)有限公司 2018-04-24 CN disclosed
CN-1644580-A Position fixable polymerized precursor of polythiazole monomer and its synthesis XU LIANGHENG (CN) 2005-07-27 CN disclosed
US-6750354-B2 ALKYLATION OF 3,4- DIHYDROXYTHIOPHENE-2, 5-DICARBOXYLIC ESTERS OR THEIR ALKALI METAL OR ALKALINE EARTH METAL SALTS WITH ALKYLATING AGENTS IN A POLAR DILUENT IN THE PRESENCE OF QUATERNARY ONIUM SALTS BAYER AKTIENGESELLSCHAFT (DE) 2004-06-15 US disclosed
US-20030097007-A1 Process for the alkylation of 3,4-dihydroxythiophene-2,5-dicarboxylic esters H. C. STARCK GMBH (DE) 2003-05-22 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-20030097007-A1 Process for the alkylation of 3,4-dihydroxythiophene-2,5-dicarboxylic esters DIMT1, AS3MT, DDT KMT2A 195/4885MAPT 1684/4885HSD17B10 719/4885

“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.