SCHEMBL7166105

SCHEMBL7166105

CCCCCC=CCCCOc1ccc(C(=O)O)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.53
THRB P10828 1/20 0.53
PTPN11 Q06124 2/20 0.51
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
PLK1 P53350 2/20 0.49
PLA2G4B P0C869 1/20 0.49
PPARA Q07869 2/20 0.47
RARB P10826 3/20 0.47

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
SCHEMBL7166101 1.00 THRA (0.53) THRATHRBPTPN11TP53TSHR
SCHEMBL7167821 0.95 THRA (0.54) THRATHRBPTPN11TP53TSHR
SCHEMBL7167816 0.95 THRA (0.54) THRATHRBPTPN11TP53TSHR
SCHEMBL7166122 0.95 THRA (0.53) THRATHRBPTPN11TP53TSHR
SCHEMBL7166116 0.95 THRA (0.53) THRATHRBPTPN11TP53TSHR
SCHEMBL7173300 0.90 PPARA (0.48) THRATHRBPTPN11TP53TSHR
SCHEMBL7173308 0.90 PPARA (0.48) THRATHRBPTPN11TP53TSHR
SCHEMBL1988903 0.89 THRA (0.64) THRATHRBPTPN11TP53TSHR
SCHEMBL1023516 0.89 THRA (0.59) THRATHRBPTPN11TP53TSHR
SCHEMBL15153314 0.88 THRA (0.66) THRATHRBPTPN11TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6569504-B1 Dimers of LC-like compounds in which the monomers are linked to each other through a high birefringence moiety (dimerization linker) DISPLAYTECH, INC. 2003-05-27 US disclosed
US-6139771-A USEFUL IN ELECTOOPTICAL AND NON-LINEAR OPTICAL APPLICATIONS DISPLAYTECH, INC. (US) 2000-10-31 US disclosed