SCHEMBL17499792

SCHEMBL17499792

Cn1cnc2c(C=Nc3ccccc3O[Si](C)(C)C)cccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.35
KDM4E B2RXH2 6/20 0.35
HPGD P15428 5/20 0.35
MAPT P10636 6/20 0.34
SMN1; SMN2 Q16637 5/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 1/20 0.32
DPP4 P27487 1/20 0.31
HSD17B10 Q99714 3/20 0.31
POLB P06746 1/20 0.31
MPI P34949 1/20 0.31
RECQL P46063 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
SCHEMBL17499785 1.00 ALDH1A1 (0.35) ALDH1A1KDM4EHPGDMAPTSMN1; SMN2
SCHEMBL16101588 0.88 MAPT (0.43) ALDH1A1KDM4EHPGDMAPTSMN1; SMN2
SCHEMBL16101590 0.88 MAPT (0.43) ALDH1A1KDM4EHPGDMAPTSMN1; SMN2
SCHEMBL16103122 0.81 MAPT (0.33) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL16103125 0.81 MAPT (0.33) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL16103541 0.80 MAPT (0.32) ALDH1A1KDM4EHPGDMAPTSMN1; SMN2
SCHEMBL16103543 0.79 BCHE (0.34) MAPTSMN1; SMN2NPC1RAB9ADPP4
SCHEMBL17499683 0.78 NOTUM (0.38) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL17499687 0.78 NOTUM (0.38) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL17499309 0.76 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDMAPTLMNA

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
EP-2969593-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORP (JP) 2020-11-04 EP disclosed
US-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed