SCHEMBL16097233

SCHEMBL16097233

COc1c(C)cccc1N=CCc1cnccn1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPM5 Q9NZQ8 1/20 0.34
SCN8A Q9UQD0 2/20 0.33
NOTUM Q6P988 2/20 0.33
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 1/20 0.32
SYK P43405 2/20 0.31
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
KMT2A Q03164 4/20 0.31
MEN1 O00255 3/20 0.31
MAPT P10636 1/20 0.30
NAAA Q02083 1/20 0.30
MCHR1 Q99705 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
SCHEMBL16097397 0.88 SCN8A (0.32) SCN8ANOTUMLMNA
SCHEMBL17499680 0.86 SCN8A (0.32) SCN8ANOTUMLMNA
SCHEMBL16097907 0.84 SCN8A (0.44) TRPM5SCN8AL3MBTL1KDM4ESYK
SCHEMBL16095208 0.82 KDM4E (0.40) LMNAL3MBTL1KDM4ESYKKMT2A
SCHEMBL16098341 0.81 SYK (0.37) TRPM5NOTUMLMNAL3MBTL1KDM4E
SCHEMBL16096168 0.80 ALDH1A1 (0.36) SCN8ALMNAL3MBTL1KDM4EKMT2A
SCHEMBL16095252 0.77 CTH (0.35) SCN8ANOTUMLMNAL3MBTL1KDM4E
SCHEMBL16095251 0.77 CTH (0.35) SCN8ANOTUMLMNAL3MBTL1KDM4E
SCHEMBL16098400 0.76 KDM4E (0.40) L3MBTL1KDM4ESYKKMT2AMEN1
SCHEMBL16095541 0.76 KDM4E (0.43) LMNAKDM4ESYKKMT2AMEN1

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
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
EP-2969593-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES Bridgestone Corporation (JP) 2016-01-20 EP disclosed
WO-2014149931-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORPORATION (JP) 2014-09-25 WO disclosed