SCHEMBL8669451

SCHEMBL8669451

CN(C)c1ccccc1/C=N\c1ccccc1N(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CA12 O43570 1/20 0.46
MAPT P10636 8/20 0.40
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 6/20 0.40
L3MBTL1 Q9Y468 4/20 0.40
POLB P06746 2/20 0.40
MPI P34949 1/20 0.40
RECQL P46063 1/20 0.40
HTT P42858 3/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 3/20 0.38
GSK3B P49841 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
TP53 P04637 2/20 0.36
HSD17B10 Q99714 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36

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
SCHEMBL9358664 0.83 SMN1; SMN2 (0.47) CA2CA9CA12MAPTKDM4E
SCHEMBL8773372 0.81 KDM4E (0.49) CA2CA9CA12MAPTKDM4E
SCHEMBL9362615 0.81 KDM4E (0.49) CA2CA9CA12MAPTKDM4E
SCHEMBL8773391 0.81 ALDH1A1 (0.53) CA2CA9MAPTKDM4EALDH1A1
SCHEMBL31426165 0.78 MAPT (0.46) CA2CA9MAPTKDM4EALDH1A1
SCHEMBL9358818 0.77 CYP3A4 (0.48) CA2CA9CA12CYP3A4CYP2D6
SCHEMBL2491893 0.77 GSK3B (0.44) CA2CA9MAPTKDM4EALDH1A1
SCHEMBL3960803 0.76 KDM4E (0.59) CA2CA9MAPTKDM4EALDH1A1
SCHEMBL3961460 0.76 KDM4E (0.59) CA2CA9MAPTKDM4EALDH1A1
SCHEMBL29834180 0.76 KDM4E (0.59) CA2CA9MAPTKDM4EALDH1A1

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-0451604-B1 Diene polymers and copolymers terminated by reaction with n-alkyl and n-aryl imines BRIDGESTONE FIRESTONE INC (US) 1994-12-21 EP claimed
CN-111344314-B Modified conjugated diene polymer and preparation method thereof 株式会社LG化学 2023-01-03 CN disclosed
EP-0572792-B1 Tire tread composition BRIDGESTONE CORP (JP) 1998-12-09 EP disclosed
EP-0572792-A1 Tire tread composition BRIDGESTONE CORPORATION (JP) 1993-12-08 EP disclosed
US-5248722-A Functionalized elastomer, oxidized carbon black, reduced hysteresis BRIDGESTONE CORPORATION (JP) 1993-09-28 US disclosed