SCHEMBL17499153

SCHEMBL17499153

COc1ccccc1CN=C(C)c1cnc(C)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
RXFP1 Q9HBX9 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
GRIN2B Q13224 3/20 0.44
GRIN1 Q05586 2/20 0.44
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CLK2 P49760 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
CDK9 P50750 1/20 0.40
CDK5 Q00535 1/20 0.40
DYRK1A Q13627 1/20 0.40
TAOK1 Q7L7X3 1/20 0.40

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
SCHEMBL28039894 0.87 KDM4E (0.45) SMN1; SMN2RXFP1L3MBTL1SLC6A2SLC6A4
SCHEMBL17499709 0.87 POLB (0.37) SMN1; SMN2RXFP1L3MBTL1GRIN2BGRIN1
SCHEMBL17499101 0.86 POLB (0.36) SMN1; SMN2RXFP1L3MBTL1GRIN2BGRIN1
SCHEMBL17499731 0.84 GRIN2B (0.42) SMN1; SMN2GRIN2BGRIN1MEN1KMT2A
SCHEMBL17499814 0.78 GRIN2B (0.44) SMN1; SMN2GRIN2BGRIN1MEN1KMT2A
SCHEMBL17499330 0.77 ALDH1A1 (0.46) SMN1; SMN2RXFP1L3MBTL1GRIN2BGRIN1
SCHEMBL16096599 0.76 GRIN2B (0.42) SMN1; SMN2L3MBTL1GRIN2BGRIN1CLK2
SCHEMBL16096597 0.76 GRIN2B (0.42) SMN1; SMN2L3MBTL1GRIN2BGRIN1CLK2
SCHEMBL16095180 0.76 GRIN2B (0.44) SMN1; SMN2L3MBTL1GRIN2BGRIN1CLK2
SCHEMBL16095182 0.76 GRIN2B (0.44) SMN1; SMN2L3MBTL1GRIN2BGRIN1CLK2

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 5 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
CN-105209268-B Heterocyclic imine functionalized polymers 株式会社普利司通 2018-05-04 CN 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
CN-105209268-A Heterocyclic imine functionalized polymers BRIDGESTONE CORP 2015-12-30 CN disclosed