SCHEMBL15440211

SCHEMBL15440211

CC(=O)CC(C)=NN(c1ccccc1)[Si](C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
ALDH1A1 P00352 4/20 0.36
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPK1 P28482 1/20 0.33
HPGD P15428 1/20 0.33
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC8 Q9BY41 1/20 0.33

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
SCHEMBL15440208 1.00 MTNR1A (0.38) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL15438957 0.92 MTNR1A (0.36) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL15438958 0.92 MTNR1A (0.36) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL15439973 0.91 MTNR1A (0.35) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL15439974 0.91 MTNR1A (0.35) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL14799570 0.90 ALDH1A1 (0.37) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL14799573 0.90 ALDH1A1 (0.37) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL15439294 0.86 ALDH1A1 (0.37) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL15439295 0.86 ALDH1A1 (0.37) MTNR1AMTNR1BALDH1A1GLATSHR
SCHEMBL15439771 0.86 KMT2A (0.46) MTNR1AMTNR1BALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9115231-B2 Polymers functionalized with protected hydrazone compounds containing an acyl group BRIDGESTONE CORPORATION (JP) 2015-08-25 US disclosed
US-20140031488-A1 Polymers Functionalized With Protected Hydrazone Compounds Containing An Acyl Group BRIDGESTONE CORPORATION (JP) 2014-01-30 US disclosed