SCHEMBL17826894

SCHEMBL17826894

Cn1c2ccccc2c2cccc(-c3ccc4c5ccccc5n(N)c4c3)c21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 1/20 0.49
FTO Q9C0B1 1/20 0.49
HSP90AA1 P07900 1/20 0.43
IDO1 P14902 1/20 0.43
GPR3 P46089 1/20 0.43
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
L3MBTL1 Q9Y468 4/20 0.38
HSD17B10 Q99714 2/20 0.38
KIF11 P52732 1/20 0.38
KDM4E B2RXH2 3/20 0.37
MAPT P10636 3/20 0.37
LIMK1 P53667 2/20 0.36
MAOB P27338 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 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
SCHEMBL16376468 0.89 ALKBH5 (0.53) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL22192125 0.84 RXRA (0.54) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL19658967 0.84 ALKBH5 (0.47) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL19417230 0.84 ALKBH5 (0.47) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL16376467 0.83 ALKBH5 (0.53) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL20977611 0.83 GPR3 (0.55) ALKBH5FTOGPR3RXRARXRB
SCHEMBL16904358 0.82 ALKBH5 (0.49) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL18566268 0.82 KDM4E (0.49) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL20977880 0.81 ALKBH5 (0.58) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL24105880 0.80 ALKBH5 (0.53) ALKBH5FTOHSP90AA1IDO1GPR3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3032606-B1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2017-11-08 EP disclosed
EP-3032606-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE Samsung SDI Co., Ltd. (KR) 2016-06-15 EP disclosed