SCHEMBL3533535

SCHEMBL3533535

Nc1ccc(S)c(C(F)(F)F)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.64
GAA P10253 2/20 0.64
GLA P06280 1/20 0.64
POLB P06746 1/20 0.64
KIF11 P52732 4/20 0.44
KDM4E B2RXH2 3/20 0.42
AR P10275 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
SRC P12931 1/20 0.42
HPGD P15428 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TLR9 Q9NR96 1/20 0.42
MAPK1 P28482 1/20 0.41
NR1H2 P55055 1/20 0.41

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
SCHEMBL2984907 0.89 TSHR (0.52) TSHRGAAGLAPOLBKIF11
SCHEMBL827884 0.80 TSHR (0.70) TSHRGAAGLAPOLBKIF11
SCHEMBL29420085 0.80 TSHR (0.70) TSHRGAAGLAPOLBKIF11
SCHEMBL17451259 0.78 TSHR (1.00) TSHRGAAGLAPOLBKIF11
SCHEMBL670777 0.78 GAA (0.67) TSHRGAAGLAPOLBKIF11
SCHEMBL29350569 0.78 TSHR (1.00) TSHRGAAGLAPOLBKIF11
SCHEMBL109685 0.78 TSHR (1.00) TSHRGAAGLAPOLBKIF11
SCHEMBL29402330 0.78 GAA (0.67) TSHRGAAGLAPOLBKIF11
Hydrochloric Acid SCHEMBL8642422 0.76 GAA (0.64) TSHRGAAGLAPOLBKIF11
Water SCHEMBL20506731 0.76 TSHR (0.95) TSHRGAAGLAPOLBKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111303426-B Polyimide film and method for preparing polyimide film by click chemistry 西北工业大学 2022-07-05 CN claimed
CN-110229158-B Thermosetting polyimide precursor with low melt viscosity and suitable for RTM (resin transfer molding) and preparation method thereof 西北工业大学 2022-06-07 CN claimed
CN-110218287-B High-performance self-repairing polyimide based on dynamic imine bond and preparation method thereof 西北工业大学 2022-03-15 CN claimed
CN-109824894-B Preparation method of polyimide film with molecular main chain alternately composed of two acid anhydrides 西北工业大学 2021-08-10 CN claimed
CN-111303426-A Polyimide film and method for preparing polyimide film by click chemistry 西北工业大学 2020-06-19 CN claimed
CN-110229158-A Low melt viscosity is suitable for the molding Thermocurable polyimide presoma of RTM and preparation method 西北工业大学 2019-09-13 CN claimed
CN-110218287-A A kind of high-performance selfreparing polyimides and preparation method based on dynamic imine linkage 西北工业大学 2019-09-10 CN claimed
CN-109824894-A A kind of Kapton preparation method that molecular backbone is alternately made of two kinds of acid anhydrides 西北工业大学 2019-05-31 CN claimed
CN-102976983-B Sulfuryl fluorine-containing diamine compound and polyimide film material and preparation method thereof HUAZHONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2015-10-21 CN claimed
CN-103739528-A Sulfuryl fluorine-containing diamine compound, polyimide film material and preparation method thereof UNIV HUAZHONG SCIENCE TECH 2014-04-23 CN claimed
CN-102976983-A Sulfuryl fluorine-containing diamine compound and polyimide film material and preparation method thereof UNIV HUAZHONG SCIENCE TECH 2013-03-20 CN claimed
CN-111303426-B Polyimide film and method for preparing polyimide film by click chemistry 西北工业大学 2022-07-05 CN disclosed
CN-110229158-B Thermosetting polyimide precursor with low melt viscosity and suitable for RTM (resin transfer molding) and preparation method thereof 西北工业大学 2022-06-07 CN disclosed
CN-110218287-B High-performance self-repairing polyimide based on dynamic imine bond and preparation method thereof 西北工业大学 2022-03-15 CN disclosed
CN-109824894-B Preparation method of polyimide film with molecular main chain alternately composed of two acid anhydrides 西北工业大学 2021-08-10 CN disclosed
EP-1578716-A1 DICARBOXYLIC ACID DERIVATIVES AS PPAR-AGONISTS NOVO NORDISK A/S (DK) 2005-09-28 EP disclosed
US-20040259950-A1 Novel compounds, their preparation and use HIGH POINT PHARMACEUTICALS, LLC 2004-12-23 US disclosed
US-20040235822-A1 Benzazepine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-11-25 US disclosed
WO-2004056740-A1 DICARBOXYLIC ACID DERIVATIVES AS PPAR-AGONISTS NOVO NORDISK A/S (DK) 2004-07-08 WO disclosed
EP-1422228-A1 BENZAZEPINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Chemical Industries, Ltd. (JP) 2004-05-26 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 (2 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-20040259950-A1 Novel compounds, their preparation and use PPARG, PPARA, PPARD TSHR 1578/4885GAA 788/4885GLA 1557/4885
US-20040235822-A1 Benzazepine derivative, process for producing the same, and use CYP1B1, CYP1A1, CYP2E1 TSHR 2872/4885GAA 2987/4885GLA 2961/4885

“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.