SCHEMBL14280830

SCHEMBL14280830

C/C(=N\c1c(C)cc(C)cc1C)c1ccc(/C(C)=N/c2c(C)cc(C)cc2C)[nH]1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TP53 P04637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL5587382 0.73 MEN1 (0.33) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL5587384 0.73 MEN1 (0.33) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL5589831 0.73 GAA (0.34) MEN1KMT2AALDH1A1TP53TDP1
SCHEMBL5589828 0.73 GAA (0.34) MEN1KMT2AALDH1A1TP53TDP1
SCHEMBL18966984 0.72 RAPGEF4 (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1513292 0.72 RAPGEF4 (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4064755 0.72 RAPGEF4 (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12599773 0.72 RAPGEF4 (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6912296 0.71 KDM4E (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6912292 0.71 KDM4E (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
US-20080021180-A1 CHROMIUM CATALYSTS ACTIVE IN OLEFIN POLYMERIZATION REPSOL QUIMICA, S.A. 2008-01-24 US disclosed
US-20080021180-A1 CHROMIUM CATALYSTS ACTIVE IN OLEFIN POLYMERIZATION REPSOL QUIMICA, S.A. 2008-01-24 US disclosed