SCHEMBL731095

SCHEMBL731095

O=C(O)c1sc(C(=O)O)c(O)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 8/20 0.50
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 1/20 0.36
KDM4E B2RXH2 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CA3 P07451 1/20 0.33
MAPT P10636 1/20 0.33
SELL P14151 1/20 0.33
SELP P16109 1/20 0.33
FUT4 P22083 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
DPP4 P27487 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL9370925 0.81 GPR35 (0.48) GPR35ALDH1A1HPGDTSHRKDM4E
SCHEMBL1086031 0.81 MAPT (0.48) GPR35ALDH1A1HPGDTSHRKDM4E
SCHEMBL23459497 0.74 GPR35 (0.37) GPR35TDP1
SCHEMBL22092 0.73 CYP1A2 (0.36) GPR35ALDH1A1HPGDTSHRKDM4E
SCHEMBL476351 0.73 GPR35 (0.67) GPR35TSHR
SCHEMBL1760864 0.72 GPR35 (0.55) GPR35ALDH1A1HPGDTSHRKDM4E
SCHEMBL11804199 0.71 GPR35 (0.48) GPR35ALDH1A1HPGDTSHRKDM4E
SCHEMBL2808132 0.71 GPR35 (0.52) GPR35ALDH1A1HPGDTSHRKDM4E
SCHEMBL18701625 0.71 DAO (0.39) GPR35ALDH1A1HPGDTSHRKDM4E
SCHEMBL18701567 0.71 MCL1 (0.50) GPR35ALDH1A1HPGDTSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116218167-B Antistatic master batch, antistatic polyester film and preparation method thereof 合肥长阳新材料科技有限公司 2023-07-21 CN claimed
CN-116218167-A Antistatic master batch, antistatic polyester film and preparation method thereof 合肥长阳新材料科技有限公司 2023-06-06 CN claimed
CN-108440580-A A kind of Zn5The preparation method of cluster Base Metal-organic framework materials and its modified material 江西省科学院应用化学研究所 2018-08-24 CN claimed
US-20100324306-A1 ELECTROCHROMIC MATERIALS UNIVERSITY OF WASHINGTON (US) 2010-12-23 US claimed
US-20090067030-A1 SYNTHESIS OF GREEN ELECTROCHROMIC MATERIALS UNIVERSITY OF WASHINGTON (US) 2009-03-12 US claimed
US-20080055701-A1 SWITCHABLE WINDOW BASED ON ELECTROCHROMIC POLYMERS UNIVERSITY OF WASHINGTON (US) 2008-03-06 US claimed
EP-1362859-B1 Process for preparing a 2-hydroxymethyl-2, 3- dihydro-thieno(3, 4-b) (1, 4) dioxine-5, 7-dicarboxylic acid diester AGFA GEVAERT NV (BE) 2005-07-13 EP claimed
US-6713637-B2 REACTION OF THE ALKALI SALT OF 3,4-DIHYDROXYTHIOPHENE-2,5-DICARBOXYLIC ACID DIESTER AND EPIHALOHYDRIN IN POLAR SOLVENT AGFA-GEVAERT (BE) 2004-03-30 US claimed
US-20030216585-A1 Process for preparing a 2- hydroxymethyl-2,3-dihydro-thieno(3,4-B)(1,4) dioxine-5,7-dicarboxylic acid diester AGFA-GEVAERT (BE) 2003-11-20 US claimed
EP-1362859-A1 Process for preparing a 2-hydroxymethyl-2, 3- dihydro-thieno(3, 4-b) (1, 4) dioxine-5, 7-dicarboxylic acid diester AGFA-GEVAERT N.V. (BE) 2003-11-19 EP claimed
EP-0022997-B1 2,2,6,6-TETRAMETHYL-4-PIPERIDYL CARBOXYLIC ACID ESTERS AND AMIDES OF MONO AND POLY ALCOHOLS, PHENOLS AND AMINES AND SYNTHETIC POLYMER COMPOSITIONS STABILIZED THEREBY ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1985-10-02 EP claimed
JP-61011290-A None JP disclosed
CN-116075500-B Capacitor with improved capacitance 基美电子公司 2024-11-26 CN disclosed
CN-118994548-A 2, 5-Furandicarboxylic acid copolyester and preparation method thereof 合肥利夫生物科技有限公司 2024-11-22 CN disclosed
CN-118994548-A 2, 5-Furandicarboxylic acid copolyester and preparation method thereof 合肥利夫生物科技有限公司 2024-11-22 CN disclosed
EP-0032748-B1 THIOPHENE DERIVATIVES UBE INDUSTRIES, LTD. (JP) 1984-08-01 EP disclosed
US-4396735-A N-HETEROCYCLIC COMPOUND AND A HETEROCYCLIC ACID HYDRAZIDE ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1983-08-02 US disclosed
US-4362831-A A HINDERED AND HETEROCYCLIC AMINE WITH A THIOALKANOIC ACID AMIDE ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1982-12-07 US disclosed
US-4336183-A 2,2,6,6-Tetramethyl-4-piperidyl carboxylic acid esters and amides of mono and poly alcohols, phenols and amines as stabilizers for synthetic polymers ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1982-06-22 US disclosed
EP-0022997-A1 2,2,6,6-Tetramethyl-4-piperidyl carboxylic acid esters and amides of mono and poly alcohols, phenols and amines and synthetic polymer compositions stabilized thereby ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1981-01-28 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 (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-20030216585-A1 Process for preparing a 2- hydroxymethyl-2,3-dihydro-thieno(3,4-B)(1,4) dioxine-5,7-dicarboxylic acid diester DHODH, TDO2, TET3 GPR35 2120/4885ALDH1A1 766/4885HPGD 1303/4885

“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.