SCHEMBL16096945

SCHEMBL16096945

COc1cccc(C)c1N=C(C)c1cn(C)cn1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 2/20 0.32
ATP4B P51164 2/20 0.32
HTR2A P28223 2/20 0.32
HTR7 P34969 2/20 0.32
PLAU P00749 2/20 0.31
AMY1A P0DUB6 1/20 0.31
HTR1A P08908 1/20 0.31
LMNA P02545 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
POLB P06746 1/20 0.30
CYP19A1 P11511 1/20 0.30
NQO2 P16083 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 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
SCHEMBL17499729 0.88 RBP4 (0.30)
SCHEMBL16096984 0.86
SCHEMBL16100440 0.84 ALDH1A1 (0.36) ATP4AATP4BLMNATSHRPOLB
SCHEMBL16102130 0.80 ALDH1A1 (0.42) PLAULMNATSHRNPC1MAPT
SCHEMBL16101252 0.80 MEN1 (0.31)
SCHEMBL16097453 0.78 PLAU (0.32) HTR2AHTR7PLAU
SCHEMBL16096919 0.77 HKDC1 (0.48) LMNANPC1MAPT
SCHEMBL16095895 0.75 KMT2A (0.45) HTR2ALMNAPOLBMAPT
SCHEMBL16102025 0.75 PLAU (0.42) PLAULMNANPC1MAPT
SCHEMBL16095783 0.74 KMT2A (0.37) LMNAPOLBNPC1MAPT

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