SCHEMBL16097685

SCHEMBL16097685

COc1ccc(C)cc1N=CCc1cccs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 4/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
POLB P06746 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MPI P34949 1/20 0.37
KMT2A Q03164 2/20 0.37
ATM Q13315 1/20 0.37
MEN1 O00255 1/20 0.37
PKM P14618 1/20 0.37
ACHE P22303 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 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
SCHEMBL16096554 0.90 TP53 (0.41) TP53L3MBTL1TDP1MAPTKDM4E
SCHEMBL16096910 0.87 KDM4E (0.38) TP53L3MBTL1TDP1MAPTKDM4E
SCHEMBL16095537 0.86 KDM4E (0.37) TP53L3MBTL1TDP1MAPTKDM4E
SCHEMBL28040598 0.85 KDM4E (0.36) TP53L3MBTL1TDP1MAPTKDM4E
SCHEMBL16098234 0.83 CYP1A2 (0.46) MAPTKDM4EHTTPOLBALDH1A1
SCHEMBL16097015 0.81 KDM4E (0.36) TP53L3MBTL1TDP1MAPTKDM4E
SCHEMBL16104953 0.79 L3MBTL1 (0.34) TP53L3MBTL1TDP1MAPTKDM4E
SCHEMBL28040335 0.78 RAB9A (0.34) TP53L3MBTL1TDP1MAPTKDM4E
SCHEMBL16097998 0.77 MAPT (0.66) TDP1MAPTKDM4EHTTPOLB
SCHEMBL16097999 0.77 MAPT (0.66) TDP1MAPTKDM4EHTTPOLB

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