SCHEMBL16097956

SCHEMBL16097956

COc1ccccc1C/N=C\c1ccncn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 1/20 0.43
GRIN2B Q13224 1/20 0.43
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 2/20 0.40
GAA P10253 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
CYP1A2 P05177 7/20 0.39
CYP3A4 P08684 7/20 0.39
CYP2C19 P33261 7/20 0.39
CYP2D6 P10635 6/20 0.39
TSHR P16473 6/20 0.39
CLK4 Q9HAZ1 4/20 0.39
CYP2C9 P11712 2/20 0.39
ALOX15 P16050 3/20 0.38
HSD17B10 Q99714 3/20 0.38
USP2 O75604 2/20 0.38

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
SCHEMBL16097957 1.00 GRIN1 (0.43) GRIN1GRIN2BALDH1A1MEN1GAA
SCHEMBL16096631 0.87 GRIN1 (0.33) GRIN1GRIN2BALDH1A1MEN1GAA
SCHEMBL16098719 0.87 TAAR1 (0.41) GRIN1GRIN2BALDH1A1MEN1KMT2A
SCHEMBL16096931 0.87 GRIN1 (0.33) GRIN1GRIN2BALDH1A1MEN1GAA
SCHEMBL16096632 0.87 GRIN1 (0.33) GRIN1GRIN2BALDH1A1MEN1GAA
SCHEMBL16096589 0.85 KDM4E (0.46) GRIN1GRIN2BALDH1A1MEN1GAA
SCHEMBL16096590 0.85 KDM4E (0.46) GRIN1GRIN2BALDH1A1MEN1GAA
SCHEMBL16098090 0.82 GRIN1 (0.43) GRIN1GRIN2BALDH1A1MEN1GAA
SCHEMBL16098089 0.82 GRIN1 (0.43) GRIN1GRIN2BALDH1A1MEN1GAA
SCHEMBL16097016 0.81 POLB (0.46) GRIN1GRIN2BALDH1A1MEN1GAA

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