SCHEMBL9762017

SCHEMBL9762017

C=COC(=O)CCCCCCCCCC[Si](CC)(CC)CC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
LMNA P02545 4/20 0.40
ALDH1A1 P00352 3/20 0.40
DGKA P23743 1/20 0.35
FAAH O00519 1/20 0.34
PAM P19021 2/20 0.33
EPHX2 P34913 1/20 0.32
MAPT P10636 2/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
DNM1 Q05193 1/20 0.30
POLB P06746 1/20 0.30
POLA1 P09884 1/20 0.30
NAAA Q02083 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
SCHEMBL9763198 0.82 TSHR (0.43) TSHRLMNAALDH1A1DGKAFAAH
SCHEMBL29092871 0.82 TSHR (0.61) TSHRLMNAALDH1A1DGKAFAAH
SCHEMBL8752681 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL15380707 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL29912563 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL15566 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL491650 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL8752652 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL20564136 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL491383 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAPAM

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
US-5000881-A Polymerizable organosilane compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 1991-03-19 US disclosed