SCHEMBL8974155

SCHEMBL8974155

CCCCCCCCOc1ccc(C(=O)Cl)c(C)c1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 5/20 0.64
THRB P10828 5/20 0.64
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
PLA2G4B P0C869 2/20 0.54
PTPN11 Q06124 2/20 0.52
RARB P10826 3/20 0.51
PLK1 P53350 1/20 0.50
PLA2G4A P47712 1/20 0.49

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
SCHEMBL11708495 1.00 THRA (0.64) THRATHRBTP53TSHRPLA2G4B
SCHEMBL18861047 0.88 PTPN11 (0.54) THRATHRBTP53TSHRPLA2G4B
SCHEMBL10944158 0.87 THRA (0.66) THRATHRBTP53TSHRPLA2G4B
SCHEMBL11245935 0.87 THRA (0.66) THRATHRBTP53TSHRPLA2G4B
SCHEMBL15153314 0.87 THRA (0.66) THRATHRBTP53TSHRPLA2G4B
SCHEMBL11705230 0.87 THRA (0.66) THRATHRBTP53TSHRPLA2G4B
SCHEMBL7171001 0.87 THRA (0.66) THRATHRBTP53TSHRPLA2G4B
SCHEMBL11706058 0.87 THRA (0.66) THRATHRBTP53TSHRPLA2G4B
SCHEMBL3066697 0.86 THRA (0.48) THRATHRBTP53
SCHEMBL11706311 0.85 THRB (0.67) THRATHRBTP53TSHRPLA2G4B

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
EP-0702668-A1 DISCOTIC COMPOUNDS FOR USE IN LIQUID CRYSTAL MIXTURES The Secretary of St. for Def. in her Britannic Maj. Governm of the Un. Kingdom of Gr. Brit. and N. Ireland (GB) 1996-03-27 EP disclosed
WO-1994029263-A1 DISCOTIC COMPOUNDS FOR USE IN LIQUID CRYSTAL MIXTURES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1994-12-22 WO disclosed