SCHEMBL1256865

SCHEMBL1256865

COc1ccc(Br)cc1OC.[MgH2]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.54
ACHE P22303 1/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
APP P05067 1/20 0.52
TDP1 Q9NUW8 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TSHR P16473 4/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44

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
SCHEMBL20509 0.97 CA2 (0.56) CA2ACHECA12CA1CA7
SCHEMBL29419589 0.97 CA2 (0.56) CA2ACHECA12CA1CA7
Ethyne SCHEMBL28045684 0.93 CA2 (0.52) CA2ACHECA12CA1CA7
Methyl Alcohol SCHEMBL28799088 0.93 CA2 (0.52) CA2ACHECA12CA1CA7
Formaldehyde SCHEMBL23581083 0.91 CA2 (0.50) CA2ACHECA12CA1CA7
SCHEMBL5607372 0.85 CA2 (0.52) CA2ACHECA12CA1CA7
SCHEMBL27601631 0.85 SMN1; SMN2 (0.54) CA2ACHECA12CA1CA7
SCHEMBL22360080 0.84 TDP1 (0.45) CA2ACHECA12CA1CA7
SCHEMBL4820063 0.83 HPGD (0.50) TDP1KDM4EALDH1A1MAPK1TSHR
SCHEMBL4908475 0.82 TDP1 (0.44) CA2ACHECA12CA1CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114835623-B New method for synthesizing Almond alkaloid (+/-) membrane 河北桑迪亚医药技术有限责任公司 2023-07-04 CN claimed
CN-114835623-A New method for synthesizing Tetragoniaceae alkaloid (+/-) Mesembrine 河北桑迪亚医药技术有限责任公司 2022-08-02 CN claimed
CN-104650059-B A kind of thiazolone oxime ether derivative and its preparation method and application 南开大学 2018-06-22 CN claimed
EP-3805193-B1 NOVEL BIPHENYL DERIVATIVE COMPOUND AND USE THEREOF UNIV EWHA IND COLLABORATION (KR) 2024-09-11 EP disclosed
US-12043594-B2 Biphenyl derivative compound and use thereof EWHA University—Industry Collaboration Foundation (KR) 2024-07-23 US disclosed
CN-114835623-B New method for synthesizing Almond alkaloid (+/-) membrane 河北桑迪亚医药技术有限责任公司 2023-07-04 CN disclosed
CN-114835623-A New method for synthesizing Tetragoniaceae alkaloid (+/-) Mesembrine 河北桑迪亚医药技术有限责任公司 2022-08-02 CN disclosed
US-20210206706-A1 Novel Biphenyl Derivative Compound and Use Thereof EWHA UNIVERSITY - INDUSTRY COLLABORATION FOUNDATION (KR) 2021-07-08 US disclosed
EP-3805193-A1 NOVEL BIPHENYL DERIVATIVE COMPOUND AND USE THEREOF Ewha University-Industry Collaboration Foundation (KR) 2021-04-14 EP disclosed
CN-110317169-A A kind of 1- substituted isoquinoline ketone compound and preparation method thereof 复旦大学 2019-10-11 CN disclosed
CN-104650059-B A kind of thiazolone oxime ether derivative and its preparation method and application 南开大学 2018-06-22 CN disclosed
EP-0536419-A1 TRICYCLIC TRIAZOLE DERIVATIVE, PRODUCTION THEREOF, AND USE THEREOF TORAY INDUSTRIES, INC. (JP) 1993-04-14 EP disclosed
CN-1066849-A Three ring triazolo derivatives, its Manufacturing approach and use TORAY INDUSTRIES (JP) 1992-12-09 CN disclosed
US-4954497-A AGRICULTURE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-09-04 US disclosed
US-4954659-A FOOD PRESERVATIVE CHEMEX PHARMACEUTICALS, INC. (US) 1990-09-04 US disclosed
EP-0330939-A2 Acrylic acid morpholides, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-09-06 EP disclosed
EP-0024943-B1 5,6,7-TRINOR-4,8-INTER-M-PHENYLENE PGI2 DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM TORAY INDUSTRIES, INC. (JP) 1983-08-17 EP disclosed
US-4387230-A Process for preparing a dihydropyridine derivative JOHN WYETH AND BROTHER LIMITED (GB) 1983-06-07 US disclosed
US-4301164-A FOR USE AS ANTIULCER AGENTS, HYPOTENSIVE AGENTS, ANTITHROMBOSIC AGENTS TORAY INDUSTRIES, INC. (JP) 1981-11-17 US disclosed
EP-0024943-A1 5,6,7-Trinor-4,8-inter-m-phenylene PGI2 derivatives and pharmaceutical compositions containing them TORAY INDUSTRIES, INC. (JP) 1981-03-11 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-12043594-B2 Biphenyl derivative compound and use thereof NME4, PCK2, DNAJA3 CA2 883/4885ACHE 3835/4885CA12 2990/4885
US-20210206706-A1 Novel Biphenyl Derivative Compound and Use Thereof NME4, PCK2, DNAJA3 CA2 772/4885ACHE 3789/4885CA12 2750/4885

“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.