SCHEMBL2480783

SCHEMBL2480783

COc1ccc([Sn](C)(C)C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.61
▸ CA2 P00918 3/20 0.61
▸ CA7 P43166 2/20 0.61
▸ CA9 Q16790 2/20 0.61
▸ CA12 O43570 1/20 0.61
▸ CA14 Q9ULX7 1/20 0.61
▸ ACHE P22303 1/20 0.50
▸ TDP1 Q9NUW8 3/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ ALDH1A1 P00352 3/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46

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
SCHEMBL19859451 0.80 CES2 (0.55) CA1CA2MAPK1ALDH1A1KDM4E
SCHEMBL19859452 0.80 CES2 (0.55) CA1CA2MAPK1ALDH1A1KDM4E
SCHEMBL11322165 0.80 CA1 (0.65) CA1CA2CA7CA9CA12
SCHEMBL5952852 0.79 CYP2A6 (0.56) CA1CA2CA7CA9CA12
SCHEMBL1593230 0.78 — —
1,4-Dimethoxybenzene SCHEMBL8489 0.78 CA1 (1.00) CA1CA2CA7CA9CA12
1,4-Dimethoxybenzene SCHEMBL21802643 0.78 CA1 (1.00) CA1CA2CA7CA9CA12
SCHEMBL11802210 0.76 CA1 (0.58) CA1CA2CA7CA9CA12
SCHEMBL11312283 0.76 CA1 (0.58) CA1CA2CA7CA9CA12
SCHEMBL11812664 0.76 CA1 (0.58) CA1CA2CA7CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210053926-A1 SUBSTITUTED BENZAZINONES AS ANTIBACTERIAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-02-25 — — US disclosed
US-10781184-B2 Substituted benzazinones as antibacterial compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-09-22 — — US disclosed
US-20180362474-A1 SUBSTITUTED BENZAZINONES AS ANTIBACTERIAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-12-20 — — US disclosed
EP-3386950-A1 SUBSTITUTED BENZAZINONES AS ANTIBACTERIAL COMPOUNDS GlaxoSmithKline Intellectual Property Development Limited (GB) 2018-10-17 — — EP disclosed
CN-108368053-A Substituted benzazepine derivatives as antibacterial compounds 葛兰素史密斯克莱知识产权发展有限公司 2018-08-03 — — CN disclosed
WO-2017098440-A1 SUBSTITUTED BENZAZINONES AS ANTIBACTERIAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-06-15 — — WO disclosed
US-9024093-B2 Fluorination of organic compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-05-05 — — US disclosed
US-20110312903-A1 FLUORINATION OF ORGANIC COMPOUNDS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2011-12-22 — — US disclosed
EP-2376408-A2 FLUORINATION OF ORGANIC COMPOUNDS President and Fellows of Harvard College (US) 2011-10-19 — — EP disclosed
WO-2010059943-A2 FLUORINATION OF ORGANIC COMPOUNDS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-05-27 — — WO disclosed
US-5409930-A Inhibits abnoramal cell proliferation; dimethoxyquinoline/ dimethylquinoline/ quinolineoxide/ and quinoxaline derivatives RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-04-25 — — US disclosed
WO-1994019351-A1 2-BENZYL-POLYCYCLIC GUANINE DERIVATIVES AND PROCESS FOR PREPARING THEM SCHERING CORPORATION (US) 1994-09-01 — — WO disclosed
US-5340833-A Antiarthritic, antiinflammatory, antitumor agents EISAI CO., LTD. (JP) 1994-08-23 — — US disclosed
EP-0568289-A2 Benzothiophenes and thienothiophenes and related compounds useful, for example, as urokinase inhibitors Eisai Co., Ltd. (JP) 1993-11-03 — — EP disclosed
WO-1992020642-A1 BIS MONO-AND BICYCLIC ARYL AND HETEROARYL COMPOUNDS WHICH INHIBIT EGF AND/OR PDGF RECEPTOR TYROSINE KINASE RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-11-26 — — WO disclosed
EP-0444889-A1 Novel synthesis of carbapenem intermediates MERCK & CO. INC. (US) 1991-09-04 — — EP disclosed
EP-0001717-B1 INSECTICIDAL COMPOSITIONS CONTAINING TETRAORGANOTIN COMPOUNDS AND METHOD FOR USING SAME M & T CHEMICALS, INC. (US) 1981-11-04 — — EP disclosed
US-4212885-A Insecticidal compositions containing certain tetraorganotin compounds and method for using same M&T CHEMICALS INC. (US) 1980-07-15 — — US disclosed
EP-0001717-A2 Insecticidal compositions containing tetraorganotin compounds and method for using same M & T CHEMICALS, INC. (US) 1979-05-02 — — EP disclosed
US-4138483-A Insecticidal compositions containing certain tetraorganotin compounds and method for using same M&T CHEMICALS INC. (US) 1979-02-06 — — 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 (4 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-20110312903-A1 FLUORINATION OF ORGANIC COMPOUNDS SLCO1B3, SLCO2B1, FLI1 CA1 779/4885CA2 2244/4885CA7 551/4885
US-20210053926-A1 SUBSTITUTED BENZAZINONES AS ANTIBACTERIAL COMPOUNDS LPXN, MLX, ZYX CA1 4882/4885CA2 3960/4885CA7 2626/4885
US-20180362474-A1 SUBSTITUTED BENZAZINONES AS ANTIBACTERIAL COMPOUNDS LPXN, MLX, ZYX CA1 4882/4885CA2 3960/4885CA7 2626/4885
US-10781184-B2 Substituted benzazinones as antibacterial compounds LPXN, MLX, ZYX CA1 4882/4885CA2 3960/4885CA7 2626/4885

“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.

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