SCHEMBL16097397

SCHEMBL16097397

Cc1cccc(N=CCc2cnccn2)c1O[Si](C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 3/20 0.32
NOTUM Q6P988 1/20 0.32
LMNA P02545 2/20 0.31
SCN4A P35499 3/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
KCNK3 O14649 1/20 0.30
CACNA1F O60840 1/20 0.30
KCNK2 O95069 1/20 0.30
GBA1 P04062 1/20 0.30
MAOA P21397 1/20 0.30
HTR2A P28223 1/20 0.30
SLC6A4 P31645 1/20 0.30
SCN1A P35498 1/20 0.30
HTR2B P41595 1/20 0.30
SCN7A Q01118 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
SCHEMBL16097233 0.88 TRPM5 (0.34) SCN8ANOTUMLMNA
SCHEMBL16097423 0.85 SCN8A (0.42) SCN8ALMNASCN4ACYP1A2CYP3A4
SCHEMBL17499680 0.84 SCN8A (0.32) SCN8ANOTUMLMNA
SCHEMBL17499338 0.82 KDM4E (0.32) NOTUMCYP1A2CYP3A4CYP2C9
SCHEMBL16097834 0.82 NOTUM (0.33) NOTUMLMNATSHR
SCHEMBL16096761 0.81 SCN4A (0.33) SCN8ALMNASCN4ACYP1A2CYP3A4
SCHEMBL16096705 0.79 KDM4E (0.34) SCN8ANOTUMLMNAMAOA
SCHEMBL16096706 0.79 KDM4E (0.34) SCN8ANOTUMLMNAMAOA
SCHEMBL16096607 0.78 GAA (0.33) CYP2D6KCNH2
SCHEMBL16097387 0.77 KDM4E (0.34) CYP2D6KCNH2

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