SCHEMBL8720511

SCHEMBL8720511

CCCCCCOc1ccc2c(ccc3cc(OCCCC[Si](C)(C)CCCC)ccc32)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
THRA P10827 1/20 0.38
GPBAR1 Q8TDU6 2/20 0.37
CYSLTR2 Q9NS75 1/20 0.37
CYSLTR1 Q9Y271 1/20 0.37
MTNR1A P48039 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
NR5A1 Q13285 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
TSHR P16473 2/20 0.36

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
SCHEMBL7884137 0.92 MAPT (0.46) MAPTTHRAGPBAR1CYSLTR2CYSLTR1
SCHEMBL7886305 0.92 MAPT (0.46) MAPTTHRAGPBAR1CYSLTR2CYSLTR1
SCHEMBL8720146 0.89 MAPT (0.40) MAPTNR5A1TSHRTP53KDM4E
SCHEMBL7884138 0.81 MAPT (0.44) MAPTNR5A1TSHRTP53KDM4E
SCHEMBL8724270 0.81 MAPT (0.44) MAPTNR5A1TSHRTP53KDM4E
SCHEMBL8720447 0.81 MAPT (0.44) MAPTNR5A1TSHRTP53KDM4E
SCHEMBL8723222 0.81 MAPT (0.44) MAPTNR5A1TSHRTP53KDM4E
SCHEMBL8722621 0.81 MAPT (0.44) MAPTNR5A1TSHRTP53KDM4E
SCHEMBL8722611 0.80 TLR8 (0.44) MAPTNR5A1TSHRTP53CYP2D6
SCHEMBL8720596 0.80 LTA4H (0.43) MAPTNR5A1TSHRTP53KDM4E

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 3 patents. 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
US-5648021-A Phenanthrene derivatives and their use in liquid-crystalline mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1997-07-15 US disclosed
WO-1997004039-A1 FERROELECTRIC LIQUID CRYSTAL MIXTURE HOECHST RESEARCH & TECHNOLOGY DEUTSCHLAND GMBH & CO. KG (DE) 1997-02-06 WO disclosed