SCHEMBL5954825

SCHEMBL5954825

C=C(C)C(=O)OC(CCCC)CCC[Si](OC)(OC)OC

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
LMNA P02545 1/20 0.34
CTSK P43235 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GLS2 Q9UI32 3/20 0.31
PRKCA P17252 1/20 0.31
PRKCD Q05655 1/20 0.31
EPHX2 P34913 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
SCHEMBL31484377 0.94 TSHR (0.38) TSHRLMNACTSKCA1CA2
SCHEMBL1132962 0.90 TSHR (0.41) TSHRLMNACA1ALDH1A1GLS2
SCHEMBL1158372 0.90 ALDH1A1 (0.35) TSHRLMNACTSKALDH1A1GLS2
SCHEMBL28135206 0.90 ALDH1A1 (0.33) TSHRALDH1A1PRKCAPRKCDEPHX2
SCHEMBL7878009 0.89 TSHR (0.43) TSHRLMNAGLS2
SCHEMBL7878019 0.89 TSHR (0.43) TSHRLMNAGLS2
SCHEMBL6832092 0.89 TSHR (0.43) TSHRLMNAGLS2
SCHEMBL7876250 0.89 TSHR (0.43) TSHRLMNAGLS2
SCHEMBL1577727 0.86 TSHR (0.48) TSHRCTSKCA1CA2ALDH1A1
SCHEMBL9015477 0.86 TSHR (0.41) TSHRLMNAGLS2

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-20060281586-A1 Compositions for use in golf balls JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2006-12-14 US disclosed