SCHEMBL3831301

SCHEMBL3831301

Cc1nc(-c2cccs2)c(F)c(F)c1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
RPS6KB2 Q9UBS0 4/20 0.43
ADORA2A P29274 1/20 0.41
DHFR P00374 1/20 0.41
KDM4E B2RXH2 5/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ADK P55263 2/20 0.41
NPC1 O15118 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
HSD17B10 Q99714 1/20 0.41
RAB9A P51151 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
SCHEMBL29947834 0.72 RPS6KB2 (0.43) MEN1KMT2ARPS6KB2ADORA2ADHFR
SCHEMBL4341036 0.71 KDM4E (0.50) MEN1KMT2ARPS6KB2ADORA2AKDM4E
SCHEMBL21058781 0.70 ADORA2A (0.59) MEN1KMT2ARPS6KB2ADORA2ADHFR
SCHEMBL16519335 0.69 RPS6KB2 (0.58) RPS6KB2ADORA2AKDM4EMAPTALDH1A1
SCHEMBL32670806 0.69 MEN1 (0.42) MEN1KMT2ARPS6KB2ADORA2ADHFR
SCHEMBL11328248 0.68 CDK5 (0.44) MEN1KMT2ARPS6KB2KDM4EMAPT
SCHEMBL27537438 0.68 ADORA2A (0.53) MEN1KMT2ARPS6KB2ADORA2ADHFR
SCHEMBL29518891 0.68 MEN1 (0.67) MEN1KMT2ARPS6KB2ADORA2ADHFR
SCHEMBL27960148 0.68 RAB9A (0.44) MEN1KMT2ARPS6KB2KDM4EMAPT
SCHEMBL616338 0.68 DHODH (0.43) MEN1KMT2ARPS6KB2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1191612-B1 Luminescence device and display apparatus CANON KK (JP) 2009-09-09 EP disclosed
US-7220495-B2 Luminescence device, display apparatus and metal coordination compound CANON KABUSHIKI KAISHA (JP) 2007-05-22 US disclosed
US-20050025996-A1 Luminescence device, display apparatus and metal coordination compound CANON KABUSHIKI KAISHA (JP) 2005-02-03 US disclosed
US-6821646-B2 CAPABLE OF PROVIDING A HIGH-EFFICIENCY LUMINESCENT STATE AT A HIGH BRIGHTNESS (OR LUMINANCE) FOR A LONG PERIOD WHILE MINIMIZING THE DETERIORATION IN LUMINESCENCE IN ENERGIZED STATE CANON KABUSHIKI KAISHA (JP) 2004-11-23 US disclosed
US-20020063516-A1 Limuninescence device, display apparatus and metal coordination compound CANON KABUSHIKI KAISHA (JP) 2002-05-30 US disclosed
EP-1191612-A2 Luminescence device, display apparatus and metal coordination compound CANON KABUSHIKI KAISHA (JP) 2002-03-27 EP disclosed