SCHEMBL1706883

SCHEMBL1706883

COc1cc(CCl)cc(OC)c1OC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.64
HTR2A P28223 1/20 0.57
HTR2C P28335 1/20 0.57
HTR2B P41595 1/20 0.57
ACHE P22303 1/20 0.52
TUBB4A P04350 3/20 0.52
TUBB P07437 3/20 0.52
TUBA3C P0DPH7 3/20 0.52
TUBA1B P68363 3/20 0.52
TUBA4A P68366 3/20 0.52
TUBB4B P68371 3/20 0.52
TUBB3 Q13509 3/20 0.52
TUBB2A Q13885 3/20 0.52
TUBB8 Q3ZCM7 3/20 0.52
TUBA3E Q6PEY2 3/20 0.52
TUBA1A Q71U36 3/20 0.52
TUBA1C Q9BQE3 3/20 0.52
TUBB6 Q9BUF5 3/20 0.52
TUBB2B Q9BVA1 3/20 0.52
TUBB1 Q9H4B7 3/20 0.52

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
SCHEMBL29010211 0.87 PTGS2 (0.50) PTGS2HTR2AHTR2CHTR2BACHE
SCHEMBL31681741 0.86 CA2 (0.50) PTGS2HTR2AHTR2CHTR2BTUBB4A
SCHEMBL29976346 0.86 HTR2A (0.48) PTGS2HTR2AHTR2CHTR2BACHE
SCHEMBL19806073 0.86 HTR2A (0.48) PTGS2HTR2AHTR2CHTR2BACHE
SCHEMBL31574690 0.86 PTGS2 (0.48) PTGS2HTR2AHTR2CHTR2BACHE
SCHEMBL27521904 0.84 TUBB4A (0.60) PTGS2HTR2AHTR2CHTR2BTUBB4A
SCHEMBL18572455 0.82 MAPT (0.54) PTGS2HTR2AHTR2CHTR2BTUBB4A
SCHEMBL10665105 0.82 HTR2A (0.64) PTGS2HTR2AHTR2CHTR2BACHE
SCHEMBL1122521 0.81 PTGS2 (0.64) PTGS2HTR2AHTR2CHTR2BACHE
SCHEMBL10878672 0.81 TTR (0.47) PTGS2HTR2AHTR2CHTR2BKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118067891-A Method for detecting impurities in 3,4, 5-trimethoxyphenylacetic acid 四川科瑞德制药股份有限公司 2024-05-24 CN claimed
CN-112538025-A Preparation method of fluorine-containing compound for hydrophobic surface treatment agent 湖北福力德鞋业有限责任公司 2021-03-23 CN claimed
CN-105198810-A 2-benzyl-1-isoquinolone compound as well as synthesis method and application thereof UNIV XI AN JIAOTONG 2015-12-30 CN claimed
CN-102791667-B Method for producing high purity aromatic methyl alcohol, and high purity aromatic methyl alcohol composition having excellent storage stability UBE INDUSTRIES 2014-11-05 CN claimed
EP-2540695-A1 METHOD FOR PRODUCING HIGH PURITY AROMATIC METHYL ALCOHOL, AND HIGH PURITY AROMATIC METHYL ALCOHOL COMPOSITION HAVING EXCELLENT STORAGE STABILITY Ube Industries, Ltd. (JP) 2013-01-02 EP claimed
US-20120323021-A1 METHOD FOR PRODUCING A HIGH-PURITY AROMATIC METHYL ALCOHOL AND HIGH-PURITY AROMATIC METHYL ALCOHOL COMPOSITION HAVING EXCELLENT PRESERVATION STABILITY UBE INDUSTRIES, LTD. (JP) 2012-12-20 US claimed
CN-102791667-A Method for producing high purity aromatic methyl alcohol, and high purity aromatic methyl alcohol composition having excellent storage stability UBE INDUSTRIES 2012-11-21 CN claimed
CN-102516042-A Method for synthesizing 3,4,5-trimethoxylbenzyl chloride TAICANG YUNTONG CHEMICAL FACTORY 2012-06-27 CN claimed
EP-4698519-A1 3,5-DIAMINOTRIAZOLE DERIVATIVES AND USES THEREOF FOR TREATING OCULAR DISEASES Centre National de la Recherche Scientifique (FR) 2026-02-25 EP disclosed
US-20250129016-A1 PHOTOREDOX METHODS FOR RADIOCYANATION OF ARENES AND USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2025-04-24 US disclosed
CN-113999232-B MAT2A inhibitors 南京正大天晴制药有限公司 2025-01-07 CN disclosed
WO-2024218236-A1 3,5-DIAMINOTRIAZOLE DERIVATIVES AND USES THEREOF FOR TREATING OCULAR DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2024-10-24 WO disclosed
CN-118067891-A Method for detecting impurities in 3,4, 5-trimethoxyphenylacetic acid 四川科瑞德制药股份有限公司 2024-05-24 CN disclosed
CN-111164074-B Heat shock protein 90 inhibitors 台北医学大学 2024-02-02 CN disclosed
US-4054659-A BRONCHODILATORS TANABE SEIYAKU CO., LTD. (JA) 1977-10-18 US disclosed
US-4051141-A ANTIINFLAMMATORY, VASODILATOR, ANTICOAGULANTS CENTRE D'ETUDES POUR L'INDUSTRIE PHARMACEUTIQUE (FR) 1977-09-27 US disclosed
US-4012389-A ANTICOAGULANTS DONAU-PHARMAZIE GESELLSCHAFT M.B.H. (OE) 1977-03-15 US disclosed
US-3980649-A Process for the manufacture of pyrimidine derivatives CHEMIE GRUNENTHAL GMBH (DT) 1976-09-14 US disclosed
US-3957790-A VASODILATORS TOKYO TANABE COMPANY, LTD. (JA) 1976-05-18 US disclosed
US-3935214-A ANTICOAGULANT DONAU-PHARMAZIE GESELLSCHAFT M.B.H. (OE) 1976-01-27 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 (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-20120323021-A1 METHOD FOR PRODUCING A HIGH-PURITY AROMATIC METHYL ALCOHOL AND HIGH-PURITY AROMATIC METHYL ALCOHOL COMPOSITION HAVING EXCELLENT PRESERVATION STABILITY ALKBH5, ALKBH2, ALKBH3 PTGS2 4164/4885HTR2A 1320/4885HTR2C 1478/4885
US-20250129016-A1 PHOTOREDOX METHODS FOR RADIOCYANATION OF ARENES AND USE THEREOF RCC2, PPOX, FTO PTGS2 3179/4885HTR2A 3440/4885HTR2C 2168/4885

“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.