SCHEMBL4955952

SCHEMBL4955952

CCC(C)OOOC(C)CC

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
LMNA P02545 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
SCHEMBL515418 0.85 TSHR (0.38) TSHRLMNA
SCHEMBL9906288 0.82
SCHEMBL13559927 0.80
SCHEMBL12709668 0.78 TSHR (0.30) TSHR
SCHEMBL14228189 0.78 TSHR (0.30) TSHR
SCHEMBL12039600 0.78 TSHR (0.30) TSHR
SCHEMBL14228190 0.78 TSHR (0.30) TSHR
SCHEMBL19821868 0.76
SCHEMBL27610223 0.76 TSHR (0.32) TSHR
SCHEMBL2208992 0.76 ALDH1A1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110475783-B Cationic ruthenium complex, preparation method and application thereof 高砂香料工业株式会社 2022-10-21 CN disclosed
US-20080131709-A1 COMPOSITE STRUCTURE WITH ORGANOPHOSPHONATE ADHERENT LAYER AND METHOD OF PREPARING ACULON INC. (US) 2008-06-05 US disclosed
WO-2008039959-A2 COMPOSITE STRUCTURE WITH ORGANOPHOSPHONATE ADHERENT LAYER AND METHOD OF PREPARING ACULON INC. (US) 2008-04-03 WO disclosed
WO-2005070911-A1 TRANSACETALISATION PROCESS MONASH UNIVERSITY (AU) 2005-08-04 WO disclosed
EP-0506068-A1 Oxidation of terminal olefins to aldehydes UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1992-09-30 EP disclosed
US-4847314-A CURABLE, HOT MELTS DESOTO, INC. (US) 1989-07-11 US disclosed
EP-0275945-A2 Polyester coatings from terephthalate polyester plastics DeSoto, Inc. (US) 1988-07-27 EP disclosed