SCHEMBL16097455

SCHEMBL16097455

COc1cccc(C)c1N=Cc1cn(C)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.38
MAPT P10636 6/20 0.35
NPC1 O15118 2/20 0.35
KDM4E B2RXH2 4/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
HSD17B10 Q99714 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 1/20 0.33
ATM Q13315 1/20 0.33
ATP4A P20648 1/20 0.32
ATP4B P51164 1/20 0.32
RAB9A P51151 1/20 0.32
TRPM5 Q9NZQ8 1/20 0.31
CYP19A1 P11511 1/20 0.31
NQO2 P16083 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL16097452 1.00 AMY1A (0.38) AMY1AMAPTNPC1KDM4EMEN1
SCHEMBL17499276 0.87 ALDH1A1 (0.30) SMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL17499273 0.87 ALDH1A1 (0.30) SMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL17499434 0.80 MAPT (0.33) AMY1AMAPTNPC1KDM4EMEN1
SCHEMBL17499437 0.80 MAPT (0.33) AMY1AMAPTNPC1KDM4EMEN1
SCHEMBL17499676 0.80 ALDH1A1 (0.45) AMY1AMAPTNPC1KDM4EMEN1
SCHEMBL17499679 0.80 ALDH1A1 (0.45) AMY1AMAPTNPC1KDM4EMEN1
SCHEMBL16098119 0.80 CYP2C9 (0.34) AMY1AMAPTNPC1SMN1; SMN2LMNA
SCHEMBL16097860 0.77 NR4A1 (0.49) MAPTNPC1KDM4EMEN1KMT2A
SCHEMBL16097858 0.77 NR4A1 (0.49) MAPTNPC1KDM4EMEN1KMT2A

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