SCHEMBL3277210

SCHEMBL3277210

C=C(CC1CCCCOC1=O)C(=O)OCC

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
FKBP1A P62942 2/20 0.34
ATM Q13315 1/20 0.34
KMT2A Q03164 2/20 0.33
HSP90AA1 P07900 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL5199972 0.88 FKBP1A (0.30) FKBP1A
SCHEMBL6840778 0.74 TSHR (0.40) ALDH1A1FKBP1ATSHRPOLB
SCHEMBL2517427 0.73 ALDH1A1 (0.40) ALDH1A1HPGDATMKMT2AMAPT
SCHEMBL30229409 0.72 KDM4E (0.44) ALDH1A1HPGDKDM4EHSD17B10KMT2A
SCHEMBL1093243 0.72 CA1 (0.39) ALDH1A1HPGDKDM4EHSD17B10FKBP1A
SCHEMBL2987389 0.71 ALDH1A1 (0.39) ALDH1A1HPGDATMKMT2AMAPT
SCHEMBL22273668 0.71 FKBP1A (0.33) FKBP1A
SCHEMBL23640661 0.71 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EHSD17B10ATM
SCHEMBL16516708 0.71 ALDH1A1 (0.40) ALDH1A1HPGDKDM4EHSD17B10FKBP1A
SCHEMBL291084 0.70 FKBP1A (0.39) FKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7855242-B2 Dental resin composition, method of manufacture, and method of use thereof PENTRON CLINICAL TECHNOLOGIES LLC (US) 2010-12-21 US claimed
US-20070049656-A1 DENTAL RESIN COMPOSITION, METHOD OF MANUFACTURE, AND METHOD OF USE THEREOF PENTRON CLINICAL TECHNOLOGIES, INC (US) 2007-03-01 US claimed
US-20040249015-A1 Method of manufacturing dental restorations KERR CORPORATION 2004-12-09 US claimed
US-6787584-B2 BIODEGRADABLE MACROMONOMER HAVING TERMINAL ACRYLATE OR METHACRYLATE GROUP(S) (ACRYLATED POLYLACTONE); A CURING COMPOSITION; A FILLER OF BIOACTIVE GLASS, APATITES, AND OTHER (METH)ACRYLATES PENTRON CORPORATION 2004-09-07 US claimed
WO-2002078646-A1 DENTAL COMPOSITIONS PENTRON CORPORATION (US) 2002-10-10 WO claimed
US-6455608-B1 CURABLE DENTAL FORMULATION COMPRISING DEGRADABLE MACROMONOMERS HAVING ONE OR MORE TERMINAL ACRYLATE OR METHACRYLATE FUNCTIONALITY, A CURING AGENT; PREPARING A SITE TO BE RESTORED IN A TOOTH AND APPLYING ABOVE FORMULATION JENERIC/PENTRON INCORPORATED 2002-09-24 US claimed
US-20020120033-A1 Biodegradable macromonomer having terminal acrylate or methacrylate group(s) (acrylated polylactone); a curing composition; a filler of bioactive glass, apatites, and other (meth)acrylates KERR CORPORATION 2002-08-29 US claimed
EP-1202701-A1 DENTAL COMPOSITIONS COMPRISING DEGRADABLE POLYMERS JENERIC/PENTRON Incorporated (US) 2002-05-08 EP claimed
WO-2001012129-A1 DENTAL COMPOSITIONS COMPRISING DEGRADABLE POLYMERS JENERIC/PENTRON INCORPORATED (US) 2001-02-22 WO claimed
US-7855242-B2 Dental resin composition, method of manufacture, and method of use thereof PENTRON CLINICAL TECHNOLOGIES LLC (US) 2010-12-21 US disclosed
US-7700667-B2 Dental resin composition, method of manufacture, and method of use thereof PENTRON CLINICAL TECHNOLOGIES, LLC (US) 2010-04-20 US disclosed
US-7275933-B2 Method of manufacturing dental restorations PENTRON CLINICAL TECHNOLOGIES, LLC (US) 2007-10-02 US disclosed
US-20070049656-A1 DENTAL RESIN COMPOSITION, METHOD OF MANUFACTURE, AND METHOD OF USE THEREOF PENTRON CLINICAL TECHNOLOGIES, INC (US) 2007-03-01 US disclosed
US-20050192374-A1 Dental resin composition, method of manufacture, and method of use thereof KERR CORPORATION 2005-09-01 US disclosed
EP-1202701-A1 DENTAL COMPOSITIONS COMPRISING DEGRADABLE POLYMERS JENERIC/PENTRON Incorporated (US) 2002-05-08 EP disclosed
US-6221546-B1 COMPRISING A WATER INSOLUBLE VINYL OR ACRYLIC POLYMER HAVING A TG LESS THAN 25 DEGREES C EASTMAN KODAK COMPANY 2001-04-24 US disclosed
WO-2001012129-A1 DENTAL COMPOSITIONS COMPRISING DEGRADABLE POLYMERS JENERIC/PENTRON INCORPORATED (US) 2001-02-22 WO disclosed
EP-1069472-A1 Coating composition for a protecting layer for gelatin based photographic products containing a 1H-pyrazolo-[1,5-b][1,2,4]-triazole-type magenta coupler EASTMAN KODAK COMPANY (US) 2001-01-17 EP disclosed
EP-1069471-A1 Coating composition for a protecting layer for image recording materials EASTMAN KODAK COMPANY (US) 2001-01-17 EP disclosed
US-6165653-A Protecting layer for gelatin based photographic products containing 1H-pyrazolo[1,5,-b][1,2,4]triazole-type magenta coupler EASTMAN KODAK COMPANY (US) 2000-12-26 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 (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-20050192374-A1 Dental resin composition, method of manufacture, and method of use thereof GRM6, MPHOSPH6, H1-0 ALDH1A1 2492/4885HPGD 1111/4885KDM4E 723/4885
US-20070049656-A1 DENTAL RESIN COMPOSITION, METHOD OF MANUFACTURE, AND METHOD OF USE THEREOF CAD, MMAB, DNMT3A ALDH1A1 1227/4885HPGD 799/4885KDM4E 495/4885

“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.