SCHEMBL17499322

SCHEMBL17499322

COc1ccccc1/N=C\c1ncccc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.43
KDM4E B2RXH2 4/20 0.43
CASP1 P29466 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
HPGD P15428 3/20 0.43
MAPT P10636 3/20 0.43
HIF1A Q16665 2/20 0.43
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
NPC1 O15118 1/20 0.42
NSD2 O96028 1/20 0.42
HSP90AA1 P07900 1/20 0.42
CASP6 P55212 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
CTH P32929 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL16096518 1.00 ALDH1A1 (0.43) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL17499586 0.86 CTH (0.39) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL17499585 0.86 CTH (0.39) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL16097772 0.85 MAPT (0.42) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL16097770 0.85 MAPT (0.42) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL17499753 0.85 CTH (0.39) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL16097088 0.84 ALDH1A1 (0.44) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL17499436 0.84 ALDH1A1 (0.44) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL16097350 0.80 ALDH1A1 (0.45) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL16097348 0.80 ALDH1A1 (0.45) ALDH1A1KDM4ECASP1HSD17B10RXFP1

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 3 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