SCHEMBL10032385

SCHEMBL10032385

c1ccc(-c2ccc3ccc4ccc(-c5ccc(-c6cc(-c7ccccc7)c7ccc8ccc(-c9ccccc9)cc8c7n6)cc5)nc4c3c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 5/20 0.40
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PARP1 P09874 1/20 0.38
TOP1 P11387 3/20 0.38
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
AURKA O14965 1/20 0.36
AURKB Q96GD4 1/20 0.36
DHODH Q02127 1/20 0.36
ALK Q9UM73 1/20 0.36
PLG P00747 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
SCHEMBL10032419 0.91 PARP1 (0.38) ACACAKDM4EALDH1A1MAPTHPGD
SCHEMBL10032535 0.89 PARP1 (0.41) ACACAKDM4EALDH1A1MAPTHPGD
SCHEMBL10032345 0.89 PARP1 (0.45) ALDH1A1HPGDL3MBTL1PARP1MEN1
SCHEMBL10032418 0.89 PARP1 (0.45) ALDH1A1HPGDL3MBTL1PARP1MEN1
SCHEMBL10032537 0.88 PARP1 (0.40) ACACAKDM4EALDH1A1MAPTHPGD
SCHEMBL10032386 0.87 CYP1A1 (0.41) KDM4EALDH1A1MAPTHPGDPARP1
SCHEMBL10032283 0.86 ACACA (0.45) ACACAKDM4EALDH1A1MAPTHPGD
SCHEMBL12112619 0.86 ACACA (0.45) ACACAKDM4EALDH1A1MAPTHPGD
SCHEMBL10032326 0.86 ACACA (0.45) ACACAKDM4EALDH1A1MAPTHPGD
SCHEMBL25850603 0.86 ACACA (0.45) ACACAKDM4EALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114529-B2 Material for lighting emitting device and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-14 US disclosed
US-8114529-B2 Material for lighting emitting device and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-14 US disclosed
US-20070267958-A1 Material for Light Emitting Device and Light Emitting Device TORAY INDUSTRIES, INC. (JP) 2007-11-22 US disclosed
US-20070267958-A1 Material for Light Emitting Device and Light Emitting Device TORAY INDUSTRIES, INC. (JP) 2007-11-22 US disclosed