SCHEMBL16062979

SCHEMBL16062979

C=CCN(CC=C)CC(O)COCCC[Si](OC)(OC)OC

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
HTT P42858 1/20 0.33
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL16062980 0.93 LMNA (0.36) USP2HTTLMNAKDM4E
SCHEMBL16062981 0.89 USP2 (0.33) USP2HTT
SCHEMBL16062978 0.86 USP2 (0.35) USP2HTTALDH1A1CYP1A2CYP3A4
SCHEMBL14666270 0.85 USP2 (0.34) USP2HTTALDH1A1CYP1A2CYP3A4
SCHEMBL9927994 0.84 USP2 (0.38) USP2HTTALDH1A1CYP1A2CYP3A4
SCHEMBL16306570 0.82 LMNA (0.45) USP2HTTCYP1A2CYP3A4CYP2C19
SCHEMBL61834 0.82 USP2 (0.37) USP2HTTALDH1A1CYP1A2CYP3A4
SCHEMBL61330 0.82 USP2 (0.37) USP2HTTALDH1A1CYP1A2CYP3A4
SCHEMBL15255243 0.82 USP2 (0.37) USP2HTTALDH1A1CYP1A2CYP3A4
SCHEMBL16710535 0.82 USP2 (0.40) USP2HTTALDH1A1CYP1A2CYP3A4

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-8835521-B2 Photosensitive composition and compound for use in the photosensitive composition LG CHEM, LTD. (KR) 2014-09-16 US disclosed