SCHEMBL1782725

SCHEMBL1782725

NCC(N)C1C2CC3CC(C2)CC1C3

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 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
Acetic Acid SCHEMBL6425310 0.86 HSD11B1 (0.38)
SCHEMBL354106 0.75
SCHEMBL356249 0.75 CYP2C9 (0.33) CYP2C9
SCHEMBL4946873 0.73 TP53 (0.38) CYP2C9
SCHEMBL354346 0.72 HSD11B1 (0.45) CYP2C9
SCHEMBL353657 0.70
SCHEMBL3279708 0.69 CYP2C9 (0.41) CYP2C9
SCHEMBL1548216 0.69 SLC22A2 (0.39) CYP2C9
SCHEMBL23302263 0.65 LMNA (0.34)
SCHEMBL5263068 0.65

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3702393-B1 PRODUCTION METHOD FOR LOW INCLUSION RATE POLYROTAXANE ASM INC (JP) 2025-01-15 EP claimed
US-11084888-B2 Production method for low inclusion rate polyrotaxane ASM, Inc. (JP) 2021-08-10 US claimed
US-20200339709-A1 PRODUCTION METHOD FOR LOW INCLUSION RATE POLYROTAXANE ASM, Inc. (JP) 2020-10-29 US claimed
EP-3702393-A1 PRODUCTION METHOD FOR LOW INCLUSION RATE POLYROTAXANE ASM Inc. (JP) 2020-09-02 EP claimed
EP-3702393-B1 PRODUCTION METHOD FOR LOW INCLUSION RATE POLYROTAXANE ASM INC (JP) 2025-01-15 EP disclosed
US-11084888-B2 Production method for low inclusion rate polyrotaxane ASM, Inc. (JP) 2021-08-10 US disclosed
US-20200339709-A1 PRODUCTION METHOD FOR LOW INCLUSION RATE POLYROTAXANE ASM, Inc. (JP) 2020-10-29 US disclosed
EP-3702393-A1 PRODUCTION METHOD FOR LOW INCLUSION RATE POLYROTAXANE ASM Inc. (JP) 2020-09-02 EP disclosed
CN-110240607-A Bis- adamantane -4,5- glyoxalidine dichloro cuprous salt of 1,3- and preparation method thereof 南京理工大学 2019-09-17 CN disclosed
US-20110118307-A1 Compositions and methods for the treatment of infectious diseases GOVERNMENT OF THE UNITED STATES OF AMERICA REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2011-05-19 US disclosed
CN-1665801-B Anti tubercular drug: compositions and methods DEPT OF HEALTH AND HUMAN SERVI 2011-05-11 CN disclosed
CN-101636376-A Antituberculous drugs: compositions and methods SEQUELLA INC 2010-01-27 CN disclosed
CN-1665801-A Anti tubercular drug: compositions and methods DEPT OF HEALTH AND HUMAN SERVI (US) 2005-09-07 CN disclosed
EP-1513825-A2 ANTI TUBERCULAR DRUG: COMPOSITIONS AND METHODS Department of Health and Human Services (US) 2005-03-16 EP disclosed
US-20040033986-A1 Anti tubercular drug: compositions and methods PROTOPOPOVA MARINA NIKOLAEVNA (US) 2004-02-19 US disclosed
WO-2003096989-A2 ANTI TUBERCULAR DRUG: COMPOSITIONS AND METHODS DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2003-11-27 WO 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-20110118307-A1 Compositions and methods for the treatment of infectious diseases TERT, C5, ELANE CYP2C9 3361/4885
US-20040033986-A1 Anti tubercular drug: compositions and methods C5, DERA, ELL CYP2C9 2638/4885

“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.