SCHEMBL17814976

SCHEMBL17814976

CCC(CC(CC(C)NCC(O)COC[SiH2]O)C(N)=O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
ADRB2 P07550 2/20 0.31
ADRB1 P08588 2/20 0.31
CNR1 P21554 1/20 0.31
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
GLA P06280 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL17810285 0.81 POLB (0.34) HPGDHTTSLC1A3SLC1A2SLC1A1
SCHEMBL17814965 0.72 KDM4E (0.32) TDP1KDM4E
SCHEMBL17810291 0.70
SCHEMBL17814932 0.68 SLC1A3 (0.31) SLC1A3SLC1A2SLC1A1TDP1KDM4E
SCHEMBL27041452 0.65 SLC1A2 (0.64) SLC1A3SLC1A2SLC1A1TDP1ADRA1A
SCHEMBL17810286 0.61 SLC1A3 (0.46) SLC1A3SLC1A2SLC1A1TSHR
SCHEMBL14460263 0.60 SLC1A3 (0.52) SLC1A3SLC1A2SLC1A1TDP1ADRA1A
SCHEMBL12049834 0.60 SLC1A3 (0.57) SLC1A3SLC1A2SLC1A1TDP1ADRA1A
SCHEMBL11236751 0.60 KDM4E (0.44) HPGDHTTPOLBADRB2ADRB1
SCHEMBL5970448 0.59 SLC1A2 (0.60) SLC1A3SLC1A2SLC1A1TDP1ADRA1A

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-20160159660-A1 SILICON CONTAINING POLYMER FLOCCULANTS CYTEC INDUSTRIES INC. (US) 2016-06-09 US disclosed