SCHEMBL17499429

SCHEMBL17499429

Cn1cc(CC=Nc2ccccc2O[Si](C)(C)C)cn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 2/20 0.32
GABRA1 P14867 1/20 0.31
GABRA5 P31644 1/20 0.31
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE1C Q14123 1/20 0.31
ALDH1A1 P00352 2/20 0.30
MGLL Q99685 1/20 0.30
PDE4B Q07343 1/20 0.30
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
TYK2 P29597 1/20 0.30
JAK3 P52333 1/20 0.30
KAT7 O95251 1/20 0.30
KAT6A Q92794 1/20 0.30
MEN1 O00255 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
SCHEMBL17499775 0.87 PDE1A (0.38) KDM4EGAAPDE1APDE1BPDE1C
SCHEMBL16101392 0.85 HPGD (0.32)
SCHEMBL16101519 0.84 HPGD (0.31) PDE4B
SCHEMBL17499285 0.84 GABRA1 (0.35) KDM1AKDM4EGABRA1GABRA5PDE1A
SCHEMBL16100696 0.83 KDM4E (0.32) KDM1AKDM4EPDE1APDE1BPDE1C
SCHEMBL16101324 0.83 JAK2 (0.31) KDM1AJAK2JAK1TYK2JAK3
SCHEMBL17499494 0.79
SCHEMBL17499165 0.78 GSK3B (0.34) KDM4EGAAALDH1A1MEN1KMT2A
SCHEMBL17499168 0.78 GSK3B (0.34) KDM4EGAAALDH1A1MEN1KMT2A
SCHEMBL17499156 0.78 CYP19A1 (0.32) ALDH1A1

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