SCHEMBL15440516

SCHEMBL15440516

C[Si](C)(C)N(Cc1ccccc1)N=C1CC(=O)CC(=NN(Cc2ccccc2)[Si](C)(C)C)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 3/20 0.35
TSHR P16473 1/20 0.35
CA2 P00918 1/20 0.34
KMT2A Q03164 3/20 0.33
SORT1 Q99523 1/20 0.33
AOC3 Q16853 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
GAA P10253 2/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
MEN1 O00255 2/20 0.31
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL15440514 1.00 NPC1 (0.36) NPC1RAB9AALDH1A1TSHRCA2
SCHEMBL15440157 0.97 SORT1 (0.36) NPC1RAB9AALDH1A1TSHRCA2
SCHEMBL15439105 0.86 MEN1 (0.40) NPC1RAB9AALDH1A1TSHRKMT2A
SCHEMBL15439103 0.86 MEN1 (0.40) NPC1RAB9AALDH1A1TSHRKMT2A
SCHEMBL15439871 0.85 ALDH1A1 (0.35) NPC1RAB9AALDH1A1TSHRCA2
SCHEMBL15439911 0.84 ALDH1A1 (0.47) NPC1RAB9AALDH1A1KMT2AGAA
SCHEMBL15439912 0.84 ALDH1A1 (0.47) NPC1RAB9AALDH1A1KMT2AGAA
SCHEMBL14799430 0.83 G6PC1 (0.39) NPC1RAB9AALDH1A1TSHRCA2
SCHEMBL14799432 0.83 G6PC1 (0.39) NPC1RAB9AALDH1A1TSHRCA2
SCHEMBL14799568 0.82 TSHR (0.41) NPC1RAB9AALDH1A1TSHRCA2

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