SCHEMBL8962606

SCHEMBL8962606

C=C(C)C(=O)OCCC[Si](Cl)(CCCCCC)CCCCCC

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.70
THRB P10828 1/20 0.45
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NAAA Q02083 1/20 0.40
ALDH1A1 P00352 2/20 0.39
RAD52 P43351 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
EPHX1 P07099 1/20 0.38
LMNA P02545 1/20 0.37
ACHE P22303 6/20 0.37
DGKA P23743 1/20 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
SCHEMBL8962671 0.94 TSHR (0.64) TSHRTHRBPOLBAPEX1HTT
SCHEMBL27832270 0.90 TSHR (0.59) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8962684 0.89 TSHR (0.68) TSHRTHRBPOLBAPEX1HTT
SCHEMBL7933425 0.87 TSHR (0.74) TSHRTHRBPOLBAPEX1HTT
SCHEMBL18037131 0.86 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL2168904 0.85 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL27812601 0.84 TSHR (0.64) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1977194 0.83 TSHR (1.00) TSHRTHRBPOLBAPEX1HTT
SCHEMBL15200 0.83 TSHR (1.00) TSHRTHRBPOLBAPEX1HTT
SCHEMBL14995 0.83 TSHR (1.00) TSHRTHRBPOLBAPEX1HTT

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