SCHEMBL4788971

SCHEMBL4788971

O=C(O)CCCOc1cccc(Cl)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.55
TP53 P04637 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C19 P33261 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
KMT2A Q03164 3/20 0.52
ALDH1A1 P00352 2/20 0.52
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.51
MRGPRX4 Q96LA9 1/20 0.51
KDM4E B2RXH2 2/20 0.50
FABP3 P05413 2/20 0.49
SNCA P37840 1/20 0.49
RAB9A P51151 1/20 0.49
FFAR4 Q5NUL3 1/20 0.48
FABP4 P15090 1/20 0.47
HTR1D P28221 2/20 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
SCHEMBL1694563 0.92 LMNA (0.56) TSHRTP53CYP1A2CYP3A4CYP2D6
SCHEMBL3161189 0.86 MEN1 (0.58) TSHRTP53CYP1A2CYP3A4CYP2C19
SCHEMBL21381328 0.83 MAPT (0.61) TSHRTP53CYP1A2CYP3A4CYP2D6
SCHEMBL6313773 0.81 PTGDR2 (0.53) TSHRTP53CYP1A2CYP3A4CYP2D6
SCHEMBL3168428 0.81 MEN1 (0.57) TP53CYP1A2CYP2D6CYP2C19TDP1
SCHEMBL9780586 0.81 KMT2A (0.65) TSHRCYP3A4KMT2AL3MBTL1FABP3
SCHEMBL692136 0.81 KMT2A (0.65) TSHRCYP2C19TDP1KMT2AALDH1A1
SCHEMBL14052680 0.80 KMT2A (0.50) TSHRTP53CYP1A2CYP3A4CYP2D6
SCHEMBL9322243 0.80 MEN1 (0.55) TP53CYP1A2CYP2D6CYP2C19TDP1
Water SCHEMBL28856010 0.79 KMT2A (0.62) TSHRTDP1KMT2AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119876042-A Hybridoma cell strain 24DB-8E7 and anti-2, 4-dichlorophenoxybutyric acid antibody produced by same 闽南师范大学 2025-04-25 CN claimed
CN-102480936-A Herbicidal concentrate compositions containing glyphosate salt and dicamba salt DOW AGROSCIENCES LLC 2012-05-30 CN claimed
WO-2005063962-A1 SYSTEM FOR COMMINUTING, EXTRACTING AND DETECTING ANALYTES IN SOLD BIOLOGICAL SAMPLES DRUG RISK SOLUTIONS, INC. (US) 2005-07-14 WO claimed
CN-119876042-A Hybridoma cell strain 24DB-8E7 and anti-2, 4-dichlorophenoxybutyric acid antibody produced by same 闽南师范大学 2025-04-25 CN disclosed
EP-2714675-B1 4H-THIENO[3,2-C]CHROMENE-BASED INHIBITORS OF NOTUM PECTINACETYLESTERASE AND METHODS OF THEIR USE LEXICON PHARMACEUTICALS INC (US) 2019-01-02 EP disclosed
EP-2714675-B1 4H-THIENO[3,2-C]CHROMENE-BASED INHIBITORS OF NOTUM PECTINACETYLESTERASE AND METHODS OF THEIR USE LEXICON PHARMACEUTICALS INC (US) 2019-01-02 EP disclosed
US-9624238-B2 4H-thieno[3,2-C]chromene-based inhibitors of Notum Pectinacetylesterase and methods of their use LEXICON PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
US-9624238-B2 4H-thieno[3,2-C]chromene-based inhibitors of Notum Pectinacetylesterase and methods of their use LEXICON PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
US-9624238-B2 4H-thieno[3,2-C]chromene-based inhibitors of Notum Pectinacetylesterase and methods of their use LEXICON PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
CN-104761521-A Biphenyl-Substituted Spirocyclic Ketoenols BAYER CROPSCIENCE AG 2015-07-08 CN disclosed
US-20140256784-A1 4H-THIENO[3,2-C]CHROMENE-BASED INHIBITORS OF NOTUM PECTINACETYLESTERASE AND METHODS OF THEIR USE OXFORD FINANCE LLC, AS COLLATERAL AGENT 2014-09-11 US disclosed
CN-102408326-A Biphenyl-substituted spirocyclic ketoenols BAYER CROPSCIENCE AG 2012-04-11 CN disclosed
CN-101547899-A Biphenyl-substituted spirocyclic keto-enols BAYER CROPSCIENCE AG (DE) 2009-09-30 CN disclosed
WO-2008156654-A2 CYTOSKELETON MODULATORS FOR TREATING METABOLIC DISORDERS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2008-12-24 WO disclosed
WO-2005063962-A1 SYSTEM FOR COMMINUTING, EXTRACTING AND DETECTING ANALYTES IN SOLD BIOLOGICAL SAMPLES DRUG RISK SOLUTIONS, INC. (US) 2005-07-14 WO disclosed
WO-2005039381-A2 COMPOSITIONS AND PROCESSES FOR ANALYSIS OF PHARMACOLOGIC AGENTS IN BIOLOGICAL SAMPLES DRUG RISK SOLUTIONS, L.L.C. (US) 2005-05-06 WO disclosed
EP-1521833-A2 SYNTHETIC HERBICIDE RESISTANCE GENE The United States of America, represented by The Secretary of Agriculture (US) 2005-04-13 EP disclosed
US-20050037386-A1 Composition and processes for analysis of pharmacologic agents in biological samples DRUG RISK SOLUTIONS, L.L.C. 2005-02-17 US disclosed
WO-2003034813-A2 SYNTHETIC HERBICIDE RESISTANCE GENE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2003-05-01 WO disclosed
US-4071617-A VINYL ALCOHOL-VINYL ACETATE COPOLYMER CHEVRON RESEARCH COMPANY (US) 1978-01-31 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-20140256784-A1 4H-THIENO[3,2-C]CHROMENE-BASED INHIBITORS OF NOTUM PECTINACETYLESTERASE AND METHODS OF THEIR USE NOTUM, CES1, ACHE TSHR 3034/4885TP53 3658/4885CYP1A2 301/4885

“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.