SCHEMBL28115646

SCHEMBL28115646

CCCCCCCCCCCCCCCCCC(=O)O[Si](O)(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.47
CES1 P23141 2/20 0.47
EPHX2 P34913 1/20 0.44
PAM P19021 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
DGKA P23743 1/20 0.43
KDM4E B2RXH2 1/20 0.43
RECQL P46063 1/20 0.43
LMNA P02545 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL1746292 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL1746076 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL1747038 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL1746452 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL1746017 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL14312713 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL1746085 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL1746122 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL1747373 0.86 CES2 (0.49) CES2CES1EPHX2PAMMEN1
SCHEMBL6376734 0.81 CES2 (0.44) CES2CES1EPHX2PAMMEN1

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
CN-103937263-B A kind of complex process of Environment-friendlyflame-retardant flame-retardant silicone rubber 浙江恒业成有机硅有限公司 2017-01-04 CN disclosed