SCHEMBL1200529

SCHEMBL1200529

O=[N+]([O-])C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 4/20 0.35
GRIN3B O60391 4/20 0.35
GRIN1 Q05586 4/20 0.35
GRIN2A Q12879 4/20 0.35
GRIN2B Q13224 4/20 0.35
GRIN2C Q14957 4/20 0.35
GRIN3A Q8TCU5 4/20 0.35
LMNA P02545 2/20 0.35
SLC22A2 O15244 1/20 0.35
SLC22A1 O15245 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
STAT6 P42226 1/20 0.35
SLC47A1 Q96FL8 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33

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
SCHEMBL5608457 0.84 CRHBP (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12017088 0.80
SCHEMBL5803834 0.77 PKM (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5608320 0.75 TSHR (0.39) LMNATSHRCRHBPCRHR2EPHX2
SCHEMBL1497436 0.75 NPC1 (0.31)
SCHEMBL8789410 0.75
SCHEMBL5191921 0.75 PKM (0.48) CRHBPCRHR2ALDH1A1
SCHEMBL5608271 0.71 PKM (0.45) LMNAGAAPOLBTHRBSMN1; SMN2
SCHEMBL6058601 0.71 ALDH1A1 (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL28118949 0.71 EPHX2 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119661365-A Novel method for producing amantadine hydrochloride 李果 2025-03-21 CN claimed
CN-119661364-A Method for producing high-purity amantadine 李果 2025-03-21 CN claimed
CN-119661366-A Preparation method and application of amantadine carbonate 李果 2025-03-21 CN claimed
CN-112479896-A Method for synthesizing and preparing amantadine dry product 天津民祥药业有限公司 2021-03-12 CN claimed
US-9301950-B2 Adamantane analogs THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-04-05 US claimed
US-20120270917-A1 ADAMANTANE ANALOGS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-10-25 US claimed
WO-2011022191-A1 ADAMANTANE ANALOGS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-02-24 WO claimed
JP-10036324-A None JP disclosed
CN-119661364-A Method for producing high-purity amantadine 李果 2025-03-21 CN disclosed
CN-119661366-A Preparation method and application of amantadine carbonate 李果 2025-03-21 CN disclosed
CN-119661365-A Novel method for producing amantadine hydrochloride 李果 2025-03-21 CN disclosed
CN-115785465-B Multi-responsiveness polarized light pigment particle and preparation method and application thereof 现代纺织技术创新中心(鉴湖实验室) 2023-08-18 CN disclosed
CN-114195787-A 2-nitro-2-azaadamantane-4, 6, 8-triol trinitrate and preparation method thereof 南京理工大学 2022-03-18 CN disclosed
EP-0990631-A1 PROCESS FOR COOXIDIZING ORGANIC COMPOUNDS, PROCESS FOR PRODUCING EPOXY COMPOUNDS AND PROCESS FOR PRODUCING ESTERS OR LACTONES Daicel Chemical Industries, Ltd. (JP) 2000-04-05 EP disclosed
US-5998661-A Preparations of organic nitro compounds through mixed oxidizing agents THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1999-12-07 US disclosed
EP-0927711-A1 ADAMANTANE DERIVATIVES AND PROCESS FOR PRODUCING THEM Daicel Chemical Industries, Ltd. (JP) 1999-07-07 EP disclosed
EP-0915077-A1 POLYMERIZABLE ADAMANTANE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME Daicel Chemical Industries, Ltd. (JP) 1999-05-12 EP disclosed
EP-0897747-A1 NITRATION OR CARBOXYLATION CATALYSTS Daicel Chemical Industries, Ltd. (JP) 1999-02-24 EP disclosed
JP-H1036324-A PRODUCTION OF 1-NITROADAMANTANE DERIVATIVE NISSAN CHEM IND LTD 1998-02-10 JP disclosed
US-4329522-A 1,3,5,7-Tetranitroadamantane and process for preparing same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1982-05-11 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-20120270917-A1 ADAMANTANE ANALOGS HAVCR2, ADORA2A, ADORA1 GRIN2D 1720/4885GRIN3B 556/4885GRIN1 570/4885

“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.