SCHEMBL28045154

SCHEMBL28045154

CCCO[Si](OCCC)(OCCC)c1ccccc1Br

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
IDO1 P14902 1/20 0.31
BLM P54132 1/20 0.30
GRM2 Q14416 1/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 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
SCHEMBL430189 0.86 ALDH1A1 (0.38) ALDH1A1LMNAMEN1KMT2ATSHR
SCHEMBL3669016 0.84 ALDH1A1 (0.34) HTR7ALDH1A1LMNATSHRCYP1A2
SCHEMBL106489 0.78 TSHR (0.35) ALDH1A1LMNAMEN1KMT2ATSHR
SCHEMBL28045159 0.78 ALDH1A1 (0.31) ALDH1A1LMNAMEN1KMT2A
SCHEMBL19809138 0.77 LMNA (0.38) ALDH1A1LMNAMEN1KMT2ATSHR
SCHEMBL61764 0.77 CYP1A2 (0.43) ALDH1A1LMNAMEN1KMT2ACYP1A2
SCHEMBL28808584 0.76 CA1 (0.43) ALDH1A1LMNATSHRCYP1A2CYP2C19
SCHEMBL1225480 0.74 NR1I2 (0.33) ALDH1A1LMNAMEN1KMT2A
SCHEMBL106133 0.74 HTR1B (0.41) ALDH1A1MEN1KMT2ATSHRCYP1A2
SCHEMBL8371242 0.74 NR1I2 (0.33) ALDH1A1LMNAMEN1KMT2ATSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105163853-A Method for manufacturing catalyst for synthesizing cyclic carbonate MARUZEN PETROCHEM CO LTD 2015-12-16 CN disclosed
CN-105163854-A Method for producing catalyst for synthesizing cyclic carbonate NAT INST OF ADVANCED IND SCIEN 2015-12-16 CN disclosed
CN-105121013-A Method for producing catalyst for cyclic carbonate synthesis MARUZEN PETROCHEM CO LTD 2015-12-02 CN disclosed