SCHEMBL2409776

SCHEMBL2409776

CNN(NC)c1ccc(C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
TSHR P16473 1/20 0.50
ACHE P22303 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPT P10636 3/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
CYP2C19 P33261 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
GFER P55789 1/20 0.34
MCL1 Q07820 1/20 0.34
HPGD P15428 1/20 0.33
CNR2 P34972 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
SCHEMBL6567263 0.76 ALDH1A1 (0.55) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL7406305 0.76 ALDH1A1 (0.52) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL2411164 0.72 ALDH1A1 (0.44) ALDH1A1TSHRACHETDP1MAPT
P-Xylene SCHEMBL659510 0.71 ACHE (0.73) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL11251562 0.70 ACHE (0.48) ALDH1A1ACHETDP1MAPTCYP2C19
SCHEMBL11879818 0.70 ESR1 (0.50)
SCHEMBL3658311 0.70 CHRM5 (0.52) ALDH1A1TSHRMAPTCYP2C19SMN1; SMN2
SCHEMBL615437 0.69 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL16982395 0.69 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL7486403 0.69 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1346717-B1 One-bottle dental bonding composition DENTSPLY SANKIN K K (JP) 2007-05-23 EP claimed
US-20030187092-A1 One-bottle dental bonding composition DENTSPLY-SANKIN K.K. (JP) 2003-10-02 US claimed
EP-1346717-A1 One-bottle dental bonding composition DENTSPLY-SANKIN K.K. (JP) 2003-09-24 EP claimed
EP-0509516-B1 Dental restoration composition SANKIN IND CO (JP) 1997-03-26 EP claimed
EP-0509516-A2 Dental restoration composition SANKIN KOGYO KABUSHIKI KAISHA (JP) 1992-10-21 EP claimed
EP-1454921-B1 RADICAL POLYMERIZATION CATALYSTS AND ADHESIVE KIT FOR DENTAL USE TOKUYAMA CORP (JP) 2021-07-28 EP disclosed
EP-1459726-B1 ADHESIVES FOR DENTAL USE TOKUYAMA CORP (JP) 2013-10-02 EP disclosed
US-8022135-B2 Embedment casting composition LUCITE INTERNATIONAL UK LIMITED (GB) 2011-09-20 US disclosed
US-20090131579-A1 Embedment Casting Composition LUCITE INTERNATIONAL UK LIMITED (GB) 2009-05-21 US disclosed
EP-1883685-A1 AN EMBEDMENT CASTING COMPOSITION Lucite International UK Limited (GB) 2008-02-06 EP disclosed
US-20070293599-A1 Dental Cement Composition UM DENTAL CO., LTD. (JP) 2007-12-20 US disclosed
EP-1346717-B1 One-bottle dental bonding composition DENTSPLY SANKIN K K (JP) 2007-05-23 EP disclosed
EP-0245820-B1 Biodegradable microspheres as a carrier for macromolecules UNIV KENTUCKY RES FOUND (US) 1995-12-27 EP disclosed
US-5160745-A Three dimensional network, sustained release of hormones, peptides, vaccines, enzymes THE UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 1992-11-03 US disclosed
EP-0509516-A2 Dental restoration composition SANKIN KOGYO KABUSHIKI KAISHA (JP) 1992-10-21 EP disclosed
US-5112880-A Strontium aluminofluorosilicate fillers and light curable resin with bis/p-2*-hydroxy-3*methacryloxy/propoxy/bisphenol A and triethylene glycol dimethacrylate and hydroxyethyl methacrylate GINGI-PAK (US) 1992-05-12 US disclosed
WO-1991013913-A1 LIGHT-CURABLE ORTHODONTIC BRACKET ADHESIVE GINGI-PAK (US) 1991-09-19 WO disclosed
US-4741872-A Preparation of biodegradable microspheres useful as carriers for macromolecules THE UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 1988-05-03 US disclosed
EP-0245820-A2 Biodegradable microspheres as a carrier for macromolecules The University of Kentucky Research Foundation (US) 1987-11-19 EP disclosed
US-4530783-A Unsaturated polyesters SNIAL RESINE POLIESTERE S.P.A. (IT) 1985-07-23 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-20070293599-A1 Dental Cement Composition ASH2L, ARCN1, AP1M1 ALDH1A1 3205/4885TSHR 4725/4885ACHE 2172/4885

“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.