SCHEMBL6843784

SCHEMBL6843784

C=CC(C=O)CCC(C)=O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
BLM P54132 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MEN1 O00255 1/20 0.33
CYP2D6 P10635 1/20 0.33
NFKB1 P19838 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.32
SLC15A2 Q16348 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
SCHEMBL11783688 0.88 ALDH1A1 (0.35) ALDH1A1TSHRSLC6A2SLC6A4BLM
SCHEMBL8469565 0.76 SLC6A2 (0.34) TSHRSLC6A2SLC6A4BLMSLC6A3
SCHEMBL12556842 0.73
Acetic Acid SCHEMBL11124201 0.73 ALDH1A1 (0.33) ALDH1A1TSHRSLC6A2SLC6A4BLM
SCHEMBL9282902 0.72
SCHEMBL18776376 0.72
SCHEMBL550997 0.72
SCHEMBL7559622 0.71
SCHEMBL15396442 0.71
SCHEMBL8058851 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040156997-A1 Electrically conductive floor coating, process for producing the floor coating, coating formulation, and method for protecting structures using the floor coating SGL ACOTEC GMBH (DE) 2004-08-12 US disclosed
US-5847027-A Hardeners for elastic epoxy resin systems VIANOVA RESINS GMBH (DE) 1998-12-08 US disclosed
US-5756634-A Liquid one component PU stoving enamels HUELS AKTIENGESELLSCHAFT (DE) 1998-05-26 US disclosed
US-5585446-A EPOXY RESIN ADHESIVE COMPOSITION HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-17 US disclosed
US-5567782-A ELASTIC ADHESIVE HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-22 US disclosed
EP-0517333-B1 Epoxy resin powder coating composition SHELL INT RESEARCH (NL) 1996-10-09 EP disclosed
US-5459208-A Elasticity at low temperatures; automobile structural adhesive HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-17 US disclosed
US-5300595-A Epoxy resin powder coating composition containing physical blend of 2-phenylimidazoline and isocyanuric acid SHELL OIL COMPANY (US) 1994-04-05 US disclosed
EP-0517333-A1 Epoxy resin powder coating composition SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-12-09 EP disclosed
US-4430474-A POLYESTERURETHANES CONTAINING URETIDIONE AND ISOPHORONE GROUPS; STORAGE STABILITY; COATINGS CHEMISCHE WERKE HUELS AG (DE) 1984-02-07 US disclosed
US-4354014-A BASED ON POLYESTERS AND E-CAPROLACTAM-BLOCKED ISOPHORONE DIISOCYANATE ADDUCTS CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DE) 1982-10-12 US disclosed
US-4210687-A SHATTERPROOF COATING FOR BOTTLES CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DE) 1980-07-01 US disclosed