SCHEMBL4755737

SCHEMBL4755737

CCCCCCCCCCCCCCCCCCCCCCCCCC[CH]O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
THRB P10828 1/20 0.50
EP300 Q09472 1/20 0.46
FAAH O00519 2/20 0.46
TRPV1 Q8NER1 1/20 0.46
DNM1 Q05193 3/20 0.45
LMNA P02545 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL588080 1.00 TSHR (0.52) TSHRTHRBEP300FAAHTRPV1
SCHEMBL588205 1.00 TSHR (0.52) TSHRTHRBEP300FAAHTRPV1
SCHEMBL3181791 1.00 TSHR (0.52) TSHRTHRBEP300FAAHTRPV1
SCHEMBL548489 1.00 TSHR (0.52) TSHRTHRBEP300FAAHTRPV1
SCHEMBL4756812 1.00 TSHR (0.52) TSHRTHRBEP300FAAHTRPV1
SCHEMBL413361 1.00
SCHEMBL4755732 1.00 TSHR (0.52) TSHRTHRBEP300FAAHTRPV1
SCHEMBL4756755 1.00 TSHR (0.52) TSHRTHRBEP300FAAHTRPV1
SCHEMBL337456 1.00 TSHR (0.52) TSHRTHRBEP300FAAHTRPV1
SCHEMBL167574 1.00

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008110612-A2 NOVEL COMPOUNDS AND LUBRICATING COMPOSITIONS COMPRISING THE SAME SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2008-09-18 WO disclosed
EP-0869185-B9 Production of optically active sphingoid compound SUMITOMO CHEMICAL CO (JP) 2004-08-11 EP disclosed
EP-0869185-B1 Production of optically active sphingoid compound SUMITOMO CHEMICAL CO (JP) 2003-09-17 EP disclosed
US-6184008-B1 USING AN ESTERASE TO TO SELECTIVELY HYDROLYZE AN ENANTIOMER OF AN ESTER OF DEFINED STRUCTURE TO PRODUCE THE ALCOHOL; COSMETICS; MEDICINAL TREATMENTS FOR SKIN AND HAIR; CHEMICAL INTERMEDIATES SUMITOMO CHEMICAL COMPANY LTD. (JP) 2001-02-06 US disclosed
EP-0869185-A2 Production of optically active sphingoid compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-07 EP disclosed