SCHEMBL182432

SCHEMBL182432

C[CH]N(CC(C)C)CC(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA9 Q16790 3/20 0.32
CYP1A2 P05177 1/20 0.32
MAPK1 P28482 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
SCHEMBL7004221 0.85
SCHEMBL2129310 0.75
SCHEMBL18676255 0.75
SCHEMBL2129308 0.75
SCHEMBL270803 0.73 CA12 (0.38) CA12CA1CA2CA9CYP1A2
SCHEMBL4510359 0.71
SCHEMBL269711 0.71 CA12 (0.35) CA12CA1CA2CA9CYP1A2
SCHEMBL10305773 0.71 CYP1A2 (0.31) CA12CA1CA2CA9CYP1A2
SCHEMBL4941316 0.71 CYP1A2 (0.31) CA12CA1CA2CA9CYP1A2
SCHEMBL4941314 0.71 CYP1A2 (0.31) CA12CA1CA2CA9CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2555747-A2 A COMBINATION OF CROSSLINKED CATIONIC POLYMER AND AMPHOLYTIC POLYMER FOR PERSONAL AND HOUSEHOLD APPLICATIONS Lubrizol Advanced Materials, Inc. (US) 2013-02-13 EP claimed
WO-2011127364-A2 A COMBINATION OF CROSSLINKED CATIONIC AND AMPHOLYTIC POLYMERS FOR PERSONAL AND HOUSEHOLD APPLICATIONS LUBRIZOL ADVANCED MATERIALS, INC. (US) 2011-10-13 WO claimed
EP-1647555-B1 THE C-GLYCOSYLISOFLAVONES HAVING ALKYLAMINOALKOXYL SUBSTITUENT, THE PREPARATION AND THE USE OF THE SAME INST RADIATION MED AMMS PLA (CN) 2011-04-20 EP claimed
US-7727965-B2 C-glycosylisoflavones having alkylaminoalkoxyl substituent, preparation and use of the same HAINAN YANGPU NEW & SPECIAL MEDICINE CO., LTD. (CN) 2010-06-01 US claimed
US-20080293642-A1 C-Glycosylisoflavones Having Alkylaminoalkoxyl Substituent, Preparation and Use of the Same INSTITUTE OF RADIATION MEDICINE, ACADEMY OF MILITARY MEDICAL SCIENCES, PLA (CN) 2008-11-27 US claimed
EP-1417190-B1 SUBSTITUTED PIPERAZINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEN INC (US) 2008-10-22 EP claimed
EP-1416933-B1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM INC (US) 2008-01-02 EP claimed
US-20070265248-A1 Substituted piperazines and methods of use AMGEN INC. (US) 2007-11-15 US claimed
US-7115607-B2 Substituted piperazinyl amides and methods of use AMGEN INC. (US) 2006-10-03 US claimed
EP-1647555-A1 THE C-GLYCOSYLISOFLAVONES HAVING ALKYLAMINOALKOXYL SUBSTITUENT, THE PREPARATION AND THE USE OF THE SAME Institute of Radiation Medicine Academy of Military Medical Sciences of the Pla (CN) 2006-04-19 EP claimed
US-6977264-B2 Substituted piperidines and methods of use AMGEN INC. (US) 2005-12-20 US claimed
US-20040006067-A1 Substituted piperidines and methods of use AMGEN INC. 2004-01-08 US claimed
US-20030220324-A1 Substituted piperazines and methods of use AMGEN INC. 2003-11-27 US claimed
WO-2024014399-A1 METHOD FOR PRODUCING FLUORINE-CONTAINING COPOLYMER AGC株式会社 2024-01-18 WO disclosed
WO-2024014400-A1 METHOD FOR PRODUCING FLUORINE-CONTAINING COPOLYMER AGC株式会社 2024-01-18 WO disclosed
EP-3864002-B1 ADDITION-FRAGMENTATION AGENT WITH PENDENT AMINE GROUPS 3M INNOVATIVE PROPERTIES COMPANY (US) 2023-12-27 EP disclosed
US-6069216-A COPOLYMER HAVING EXCELLENT THIXOTROPY, EXHIBITING HIGH ADSORBABILITY TO SKIN AND HAIR; WHEN INCORPORATED AS THICKENER IN COSMETICS, MANIFESTS VERY SATISFACTORY TACTILE SENSATION KAO CORPORATION (JP) 2000-05-30 US disclosed
EP-0884334-A2 Cationic group-containing copolymer and thickener Kao Corporation (JP) 1998-12-16 EP disclosed
EP-0697407-B1 Pyrimidinedione derivatives and antiarrhythmic compositions containing same MITSUI TOATSU CHEMICALS (JP) 1997-06-25 EP disclosed
EP-0697407-A1 Pyrimidinedione derivatives and antiarrhythmic compositions containing same MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-02-21 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 (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-20030220324-A1 Substituted piperazines and methods of use MC5R, MC4R, MC1R CA12 3977/4885CA1 4542/4885CA2 3148/4885
US-20080293642-A1 C-Glycosylisoflavones Having Alkylaminoalkoxyl Substituent, Preparation and Use of the Same UGCG, PIGO, GPI CA12 492/4885CA1 584/4885CA2 367/4885
US-20070265248-A1 Substituted piperazines and methods of use MC5R, MC4R, MC1R CA12 3977/4885CA1 4542/4885CA2 3148/4885
US-20040006067-A1 Substituted piperidines and methods of use MC4R, MC5R, MC1R CA12 4764/4885CA1 4656/4885CA2 3303/4885

“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.