SCHEMBL8962674

SCHEMBL8962674

C=C(C)COCCC[Si](C)(Cl)CCCCCC

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.43
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
USP2 O75604 1/20 0.31
CES1 P23141 1/20 0.30

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
SCHEMBL8962458 0.93 CES2 (0.38) CES2TSHR
SCHEMBL8962601 0.89 CES2 (0.44) CES2HTTMEN1THRBKMT2A
SCHEMBL8962666 0.81 CES2 (0.39) CES2TSHR
SCHEMBL25424773 0.80 CES2 (0.63) CES2HTTMEN1THRBKMT2A
SCHEMBL1633949 0.80 CES2 (0.63) CES2HTTMEN1THRBKMT2A
SCHEMBL16107083 0.80 CES2 (0.63) CES2HTTMEN1THRBKMT2A
SCHEMBL14939700 0.80 CES2 (0.63) CES2HTTMEN1THRBKMT2A
SCHEMBL1636629 0.80 CES2 (0.63) CES2HTTMEN1THRBKMT2A
SCHEMBL1635179 0.80 CES2 (0.63) CES2HTTMEN1THRBKMT2A
SCHEMBL23321700 0.80 CES2 (0.36) CES2

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-5554706-A LOW TEMPERATURE LIQUID CRYSTALS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-09-10 US disclosed
EP-0695770-A1 COPOLYMER HAVING LIQUID CRYSTAL GROUP IN THE SIDE CHAIN SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-02-07 EP disclosed