SCHEMBL16096595

SCHEMBL16096595

COc1ccccc1N=Cc1ncc2nccnc2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.37
MAPT P10636 7/20 0.37
HPGD P15428 5/20 0.37
HIF1A Q16665 2/20 0.37
KDM4E B2RXH2 6/20 0.37
CASP1 P29466 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
STAT6 P42226 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 3/20 0.33
RAB9A P51151 3/20 0.33
NPC1 O15118 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL16096594 1.00 ALDH1A1 (0.37) ALDH1A1MAPTHPGDHIF1AKDM4E
SCHEMBL17499191 0.88 ALDH1A1 (0.30) ALDH1A1
SCHEMBL17499193 0.88 ALDH1A1 (0.30) ALDH1A1
SCHEMBL17499390 0.86
SCHEMBL16096803 0.84 KDM4E (0.36) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL16096947 0.84 CYP1B1 (0.36) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL16096799 0.84 KDM4E (0.36) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL16096950 0.84 CYP1B1 (0.36) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL16096060 0.82 ALDH1A1 (0.37) ALDH1A1MAPTHPGDKDM4EL3MBTL1
SCHEMBL16096059 0.82 ALDH1A1 (0.37) ALDH1A1MAPTHPGDKDM4EL3MBTL1

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