SCHEMBL16096005

SCHEMBL16096005

COC(CN=Cc1ccncc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TAAR1 Q96RJ0 1/20 0.43
G6PC1 P35575 1/20 0.40
MET P08581 1/20 0.38
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
DHFR P00374 1/20 0.37
ALDH1A1 P00352 3/20 0.36
CYP19A1 P11511 1/20 0.36
CYP11B2 P19099 1/20 0.36
AKT1 P31749 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
ROCK2 O75116 2/20 0.35
PKM P14618 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
MAPT P10636 2/20 0.35
GRK2 P25098 1/20 0.35

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
SCHEMBL16102679 0.86 KMT2A (0.41) MEN1KMT2ATAAR1G6PC1MET
SCHEMBL16097842 0.85 ALDH1A1 (0.46) MEN1KMT2ATAAR1G6PC1ALDH1A1
SCHEMBL16097741 0.84 TAAR1 (0.39) MEN1KMT2ATAAR1ALDH1A1GAA
SCHEMBL16098722 0.81 MEN1 (0.34) MEN1KMT2ATAAR1SLC6A2SLC6A4
SCHEMBL16099271 0.81 MEN1 (0.38) MEN1KMT2ATAAR1G6PC1MET
SCHEMBL16097757 0.78 MAOA (0.44) MEN1KMT2ATAAR1G6PC1ALDH1A1
SCHEMBL16097183 0.78 MEN1 (0.36) MEN1KMT2ATAAR1DYRK3CLK1
SCHEMBL16095533 0.78 MEN1 (0.34) MEN1KMT2ATAAR1SLC6A2SLC6A4
SCHEMBL16095846 0.77 KMT2A (0.41) MEN1KMT2ATAAR1GAADYRK3
SCHEMBL16095890 0.77 MEN1 (0.39) MEN1KMT2ATAAR1SLC6A2SLC6A3

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 7 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
EP-2969593-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES Bridgestone Corporation (JP) 2016-01-20 EP disclosed
CN-105209268-A Heterocyclic imine functionalized polymers BRIDGESTONE CORP 2015-12-30 CN disclosed
WO-2014149931-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORPORATION (JP) 2014-09-25 WO disclosed