SCHEMBL3089462

SCHEMBL3089462

CCN1C(C)CNCC1C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.33
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
HTR2C P28335 1/20 0.30

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
SCHEMBL18569094 1.00 FUCA1 (0.33) FUCA1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL3590322 1.00 FUCA1 (0.33) FUCA1CHRNB2CHRNB4CHRNA3CHRNA7
Hydrochloric Acid SCHEMBL15547502 0.97 FUCA1 (0.32) FUCA1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL23559839 0.84 FUCA1 (0.37) FUCA1CHRNB2CHRNB4CHRNA3CHRNA7
Trifluoroacetic Acid SCHEMBL15547392 0.80 HTR2C (0.35) FUCA1CHRNB2CHRNB4CHRNA3CHRNA7
Trifluoroacetic Acid SCHEMBL21847051 0.80 HTR2C (0.35) FUCA1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL27572881 0.80
SCHEMBL2928744 0.79 FUCA1 (0.31) FUCA1
SCHEMBL24812981 0.79 FUCA1 (0.31) FUCA1
SCHEMBL30574698 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4400497-A1 3CLPRO PROTEASE INHIBITOR Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2024-07-17 EP disclosed
EP-3640248-B1 AMINOPYRIMIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING ADAMADLE BIOTECHNOLOGY LLC (CN) 2023-08-23 EP disclosed
EP-3601297-B9 COMPOUNDS THAT INHIBIT MCL-1 PROTEIN AMGEN INC (US) 2023-05-24 EP disclosed
WO-2023016447-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-02-16 WO disclosed
US-11352352-B2 Aminopyrimidine compound, preparation method therefor and use thereof Beijing Adamadle Biotechnology Limited Liability Company (CN) 2022-06-07 US disclosed
EP-3640248-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Adamadle Biotechnology Limited Liability Company (CN) 2020-04-22 EP disclosed
US-20200087296-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Adamadle Biotechnology Limited Liability Company (CN) 2020-03-19 US disclosed
WO-2019020657-A1 PYRIDINE-3-SULFONAMIDE COMPOUNDS AS PI3-KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-31 WO disclosed
US-9908890-B2 Selective inhibitors of constitutive androstane receptor ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2018-03-06 US disclosed
US-9889130-B2 Substituted 3-benzofuranyl-indol-2-one-3-acetamididopiperazine derivatives, preparation thereof, and therapeutic use thereof SANOFI (FR) 2018-02-13 US disclosed
EP-0861660-B9 Curative medicine for disease caused by infection of Helicobacter KANEKA CORP (JP) 2006-06-28 EP disclosed
EP-0861660-B1 Curative medicine for disease caused by infection of Helicobacter KANEKA CORP (JP) 2005-04-27 EP disclosed
EP-0787494-B1 Use of rifamycin derivatives for the manufacture of a medicament for the treatment of diseases caused by infections of helicobacter pylori KANEKA CORP (JP) 2004-06-09 EP disclosed
EP-1305048-A2 INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES Wockhardt Limited (IN) 2003-05-02 EP disclosed
US-20020177559-A1 Quinolone derivatives WOCKHARDT LIMITED 2002-11-28 US disclosed
WO-2002009758-A2 INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES WOCKHARDT LIMITED (IN) 2002-02-07 WO disclosed
US-5981522-A ADMINISTERING RIFAMYCIN DERIVATIVE TO THE PATIENT TO TREAT GASTRITIS, GASTRODUODENITIS, EROSIVE GASTRITIS, GASTRIC EROSION, EROSIVE DUODENITIS, GASTRIC ULCER AND DUODENAL ULCER CAUSED BY HELICOBACTER PLORI KANEKA CORPORATION (JP) 1999-11-09 US disclosed
EP-0861660-A1 Curative medicine for disease caused by infection of Helicobacter KANEKA CORPORATION (JP) 1998-09-02 EP disclosed
EP-0787494-A1 REMEDY FOR DISEASES CAUSED BY INFECTION WITH HELICOBACTER KANEKA CORPORATION (JP) 1997-08-06 EP disclosed
US-4138566-A Piperazinyl cyclobutenones G. D. SEARLE & CO. (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 (3 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-20200087296-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, WEE2, EGFR FUCA1 3717/4885CHRNB2 4875/4885CHRNB4 4872/4885
US-11352352-B2 Aminopyrimidine compound, preparation method therefor and use thereof WEE1, WEE2, EGFR FUCA1 3717/4885CHRNB2 4875/4885CHRNB4 4872/4885
US-20020177559-A1 Quinolone derivatives ABCB11, ABCB1, ABCG2 FUCA1 1870/4885CHRNB2 4288/4885CHRNB4 4189/4885

“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.