SCHEMBL17499397

SCHEMBL17499397

CC(=NCc1ccccc1O[SiH](C)C)c1ncc[nH]1

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.32
GRIN2B Q13224 3/20 0.32
HTR7 P34969 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
CLK2 P49760 1/20 0.30
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30
CDK9 P50750 1/20 0.30
CDK5 Q00535 1/20 0.30
DYRK1A Q13627 1/20 0.30
TAOK1 Q7L7X3 1/20 0.30
CLK4 Q9HAZ1 1/20 0.30
DYRK1B Q9Y463 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
SCHEMBL17499765 0.86 GRIN2B (0.42) GRIN1GRIN2BCLK2GSK3AGSK3B
SCHEMBL16098425 0.84 GLA (0.32) GRIN1GRIN2BHTR7KMT2ANPC1
SCHEMBL16098426 0.84 GLA (0.32) GRIN1GRIN2BHTR7KMT2ANPC1
SCHEMBL17499620 0.79 KMT2A (0.33) KMT2ANPC1RAB9A
SCHEMBL17499826 0.78 GRIN1 (0.32) GRIN1GRIN2BHTR7
SCHEMBL16097693 0.77 NPC1 (0.32) GRIN1GRIN2BHTR7NPC1RAB9A
SCHEMBL16096615 0.77 GRIN1 (0.32) GRIN1GRIN2BHTR7
SCHEMBL16096649 0.76 IDO1 (0.33) GRIN1GRIN2BNPC1RAB9A
SCHEMBL17499694 0.75 GRIN2B (0.33) GRIN1GRIN2BHTR7
SCHEMBL17499700 0.75 GRIN1 (0.33) GRIN1GRIN2BHTR7

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-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