SCHEMBL131126

SCHEMBL131126

ClCc1cc(Cl)cc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
IDO1 P14902 3/20 0.48
CYP3A4 P08684 3/20 0.40
TP53 P04637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
ALDH1A1 P00352 2/20 0.35
PNMT P11086 1/20 0.35
DAO P14920 1/20 0.34
DBH P09172 1/20 0.34
TPMT P51580 1/20 0.33
TACR1 P25103 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
DEPTOR Q8TB45 1/20 0.32
RECQL P46063 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL4534250 0.97 TSHR (0.50) TSHRIDO1CYP3A4TP53L3MBTL1
SCHEMBL11743237 0.93 TSHR (0.44) TSHRIDO1CYP3A4TP53L3MBTL1
SCHEMBL28894230 0.87 TSHR (0.40) TSHRIDO1CYP3A4TP53L3MBTL1
SCHEMBL11868765 0.84 TSHR (0.38) TSHRIDO1CYP3A4TP53L3MBTL1
SCHEMBL31322887 0.81 DAO (0.38) TSHRIDO1DAO
SCHEMBL14114133 0.81 IDO1 (0.34) TSHRIDO1ALDH1A1RECQLTTR
SCHEMBL14750162 0.81 DAO (0.38) TSHRIDO1DAO
SCHEMBL1050358 0.78 CA1 (0.33) TSHR
SCHEMBL92904 0.78 TSHR (0.50) TSHRIDO1CYP3A4TP53L3MBTL1
SCHEMBL10974821 0.77 TSHR (0.38) TSHRIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117410054-A Sintered NdFeB magnet with high coercivity consistency and preparation method thereof 烟台正海磁性材料股份有限公司 2024-01-16 CN claimed
CN-117050053-A Novel thiophene antitumor compound and preparation method and application thereof 北京中医药大学 2023-11-14 CN claimed
CN-117003705-A Novel 1,2, 3-triazole compound with anti-tumor effect, and preparation method and application thereof 北京中医药大学 2023-11-07 CN claimed
CN-116947791-A Furanamide antitumor compound and preparation method and application thereof 北京中医药大学 2023-10-27 CN claimed
CN-109287647-A A kind of herbicide and preparation method thereof containing halosulfuronmethyl 安徽圣丰生化有限公司 2019-02-01 CN claimed
CN-109232164-A The synthetic method of herbicide oxaziclomefone intermediate 3,5- dichloro benzyl chloride 山东省农药科学研究院 2019-01-18 CN claimed
CN-109221192-A A kind of herbicidal composition and preparation method thereof containing penoxsuam 安徽圣丰生化有限公司 2019-01-18 CN claimed
CN-109105380-A A kind of herbicidal composition of penoxsuam and KIH 6127 安徽圣丰生化有限公司 2019-01-01 CN claimed
CN-108271797-A A kind of herbicidal composition and preparation method thereof containing penoxsuam 安徽圣丰生化有限公司 2018-07-13 CN claimed
US-12559461-B2 Antibiotic adjuvant compounds UNIVERSITY OF NOTRE DAME DU LAC (US) 2026-02-24 US disclosed
CN-116947791-B Furanamide antitumor compound and preparation method and application thereof 北京中医药大学 2025-04-25 CN disclosed
CN-114988982-B Method for synthesizing 3, 5-dichlorotoluene through isomerization 江苏聚由新材料科技有限公司 2024-12-03 CN disclosed
CN-119039287-A Tetrahydropyridopyrimidinone derivative, and preparation method and application thereof 中国药科大学 2024-11-29 CN disclosed
CN-118955242-A Method for preparing m-dichlorobenzene and 3, 5-dichlorotoluene by one-pot method 帕潘纳(北京)科技有限公司 2024-11-15 CN disclosed
EP-0008532-B1 SYNTHESIS OF AMINES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-07-20 EP disclosed
US-4374992-A ANTIULCER AND ANTISECRETORY AGENTS JOHN WYETH AND BROTHER LIMITED (GB) 1983-02-22 US disclosed
US-4370477-A ANTIULCER AGENT JOHN WYETH AND BROTHER LIMITED (GB) 1983-01-25 US disclosed
US-4304781-A Treatment of ulcers and hypertension JOHN WYETH & BROTHER LIMITED (GB) 1981-12-08 US disclosed
EP-0008532-A1 Synthesis of amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-03-05 EP disclosed
US-4185992-A Imidazole derivatives MAY & BAKER LIMITED (GB) 1980-01-29 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-12559461-B2 Antibiotic adjuvant compounds MYD88, TLR5, TLR4 TSHR 1753/4885IDO1 3035/4885CYP3A4 1638/4885

“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.