SCHEMBL6347703

SCHEMBL6347703

NCCCCCCN1CCCC1

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.70
KEAP1 Q14145 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAPT P10636 1/20 0.48
SIGMAR1 Q99720 3/20 0.47
ALOX15 P16050 1/20 0.46
CXCR4 P61073 1/20 0.45

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
SCHEMBL8554508 1.00 HRH3 (0.70) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
SCHEMBL854695 1.00 HRH3 (0.70) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
SCHEMBL11179088 1.00 HRH3 (0.70) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
SCHEMBL21799504 0.97 HRH3 (0.75) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
Hydrazine SCHEMBL8556857 0.97 HRH3 (0.67) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
SCHEMBL7230416 0.97 HRH3 (0.75) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
SCHEMBL491616 0.97 HRH3 (0.75) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
SCHEMBL21799578 0.97 HRH3 (0.75) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
SCHEMBL21799790 0.97 HRH3 (0.75) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1
SCHEMBL5839696 0.97 HRH3 (0.75) HRH3KEAP1SMN1; SMN2MAPTSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103122364-A Antitubercular inhibitor screened target gene Rv2498c and application thereof UNIV HUAZHONG AGRICULTURAL 2013-05-29 CN claimed
US-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES CAPSTAN THERAPEUTICS, INC. (US) 2023-10-12 US disclosed
US-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES CAPSTAN THERAPEUTICS, INC. (US) 2023-10-12 US disclosed
WO-2023071601-A1 DESLORATADINE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 天津市昕晨投资发展有限公司 2023-05-04 WO disclosed
US-6878736-B1 Histamine H3 receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2005-04-12 US disclosed
EP-1056733-B1 HISTAMINE H3 RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2004-01-07 EP disclosed
US-20030153604-A1 Substituted (aminoiminomethyl or aminomethyl) benzoheteroaryl compounds AVENTIS PHARMACEUTICALS INC. 2003-08-14 US disclosed
US-6541505-B1 Inhibiting the activity of Factor Xa; treating a disease state associated with a physiologically detrimental excess amount of thrombin. AVENTIS PHARMACEUTICALS INC. 2003-04-01 US disclosed
EP-1140901-A2 SUBSTITUTED (AMINOIMINOMETHYL OR AMINOMETHYL)BENZOHETEROARYL COMPOUNDS AS FACTOR XA INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2001-10-10 EP disclosed
WO-2000039087-A2 SUBSTITUTED (AMINOIMINOMETHYL OR AMINOMETHYL)BENZOHETEROARYL COMPOUNDS AS FACTOR XA INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-07-06 WO disclosed
CN-1031618-C Immunomodulatory azaspiranes SMITHKLINE BECKMAN CORP (US) 1996-04-24 CN disclosed
EP-0310321-B1 Immunomodulatory azaspiranes SMITHKLINE BEECHAM CORP (US) 1994-11-30 EP disclosed
WO-1989002889-A1 IMMUNOMODULATORY AZASPIRANES SMITHKLINE BECKMAN CORPORATION (US) 1989-04-06 WO disclosed
EP-0310321-A2 Immunomodulatory azaspiranes SMITHKLINE BEECHAM CORPORATION (US) 1989-04-05 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-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES PLTP, LNPEP, PLIN3 HRH3 2171/4885KEAP1 4175/4885SMN1; SMN2 2768/4885
US-20030153604-A1 Substituted (aminoiminomethyl or aminomethyl) benzoheteroaryl compounds SERPINC1, F2, F11 HRH3 908/4885KEAP1 1243/4885SMN1; SMN2 2242/4885

“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.