SCHEMBL4633612

SCHEMBL4633612

CCN1c2ccccc2Sc2cc(/C=C/c3cc(C#N)c(/C=C/c4ccc5c(c4)Sc4ccccc4N5CC)cc3C#N)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 2/20 0.38
HTT P42858 1/20 0.38
KDM1A O60341 3/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
RAB9A P51151 3/20 0.37
USP2 O75604 2/20 0.37
CRHBP P24387 2/20 0.37
CRHR2 Q13324 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 2/20 0.37
IDE P14735 1/20 0.36
FNTA P49354 3/20 0.36
FNTB P49356 3/20 0.36
PTGS1 P23219 2/20 0.35
PTGS2 P35354 2/20 0.35
APP P05067 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL4633617 1.00 MAPT (0.38) MAPTALDH1A1HPGDHTTKDM1A
SCHEMBL14461275 0.86 MAPT (0.38) MAPTALDH1A1HPGDHTTKDM1A
SCHEMBL14461301 0.84 MEN1 (0.35) MAPTHPGDMEN1KMT2ARAB9A
SCHEMBL14462117 0.82 MEN1 (0.37) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL4633647 0.79 SLC1A3 (0.35) MAPTALDH1A1HTTMEN1KMT2A
SCHEMBL4633653 0.79 SLC1A3 (0.35) MAPTALDH1A1HTTMEN1KMT2A
SCHEMBL22292242 0.78 MAPT (0.45) MAPTALDH1A1HPGDHTTKDM1A
SCHEMBL4632567 0.77 ALDH1A1 (0.48) MAPTALDH1A1HPGDHTTKDM1A
SCHEMBL31481617 0.77 ALDH1A1 (0.48) MAPTALDH1A1HPGDHTTKDM1A
SCHEMBL28910961 0.77 PTGS1 (0.45) MAPTALDH1A1HPGDHTTKDM1A

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
EP-1619230-B1 Red light emitting compounds for organic electroluminescent devices and organic electroluminescent devices using them LG ELECTRONICS INC (KR) 2008-05-28 EP disclosed
US-7261952-B2 Red color emitting compounds for organic electroluminescent device and an organic electroluminescent device using them LG ELECTRONICS INC. (KR) 2007-08-28 US disclosed
EP-1435384-B9 Red light emitting compounds for organic electroluminescent devices and organic electroluminescent devices using them LG ELECTRONICS INC (KR) 2006-11-15 EP disclosed
EP-1435384-B1 Red light emitting compounds for organic electroluminescent devices and organic electroluminescent devices using them LG ELECTRONICS INC (KR) 2006-09-06 EP disclosed