SCHEMBL8722767

SCHEMBL8722767

CCCCCCCCCOc1ccc2c(c1)CCc1c-2ccc(OCCCC)c1F

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.47
THRB P10828 3/20 0.47
MAOB P27338 4/20 0.41
PDK2 Q15119 2/20 0.40
PTPN11 Q06124 2/20 0.39
NR5A1 Q13285 1/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTPN1 P18031 1/20 0.37
HTR1D P28221 2/20 0.37
HTR1B P28222 2/20 0.37
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL8930853 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8930861 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8930855 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8903121 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8930857 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8904145 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8930862 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8724573 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8719780 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11
SCHEMBL8724559 1.00 THRA (0.47) THRATHRBMAOBPDK2PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0839173-A1 FERROELECTRIC LIQUID CRYSTAL MIXTURE Hoechst Research & Technology Deutschland GmbH & Co. KG (DE) 1998-05-06 EP disclosed