SCHEMBL6169243

SCHEMBL6169243

Nc1[c]ccc(-c2ccncc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
MAPT P10636 3/20 0.46
AAK1 Q2M2I8 1/20 0.44
QDPR P09417 1/20 0.41
PDPK1 O15530 2/20 0.41
JAK2 O60674 1/20 0.41
PIK3CD O00329 2/20 0.40
PIK3CA P42336 2/20 0.40
PIK3CB P42338 2/20 0.40
PIK3CG P48736 2/20 0.40
MAP4K4 O95819 1/20 0.40
PIP5K1C O60331 1/20 0.40
PI4KA P42356 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
NOTUM Q6P988 1/20 0.39
AURKA O14965 3/20 0.38
TTK P33981 3/20 0.38
AURKB Q96GD4 3/20 0.38
INCENP Q9NQS7 3/20 0.38
MEN1 O00255 2/20 0.38

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
SCHEMBL3296186 0.78 MAOA (0.48) LMNAMAPTJAK2PIK3CAMAP4K4
SCHEMBL27588635 0.78 TDP1 (0.50) MAPTMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL6166769 0.77 MKNK1 (0.58) LMNAMAPTPIK3CDPIK3CAPIP5K1C
SCHEMBL27955545 0.77 MAPT (0.48) LMNAMAPTAAK1QDPRPDPK1
SCHEMBL6033529 0.76 HSP90AA1 (0.39) MAPTPIK3CDPIK3CAMAP4K4CYP2D6
SCHEMBL23165732 0.75 MAPT (0.46) LMNAMAPTAAK1QDPRNOTUM
SCHEMBL27606388 0.75 ESR2 (0.47) MEN1ALDH1A1KMT2ACYP3A4THRB
SCHEMBL27588591 0.75 ALOX5 (0.42) LMNAJAK2MAP4K4NOTUMALDH1A1
SCHEMBL6169525 0.73 PI4KA (0.41) PIK3CDPIK3CGMAP4K4PIP5K1CPI4KA
SCHEMBL8657943 0.72 HSP90AA1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1542975-A2 9-CYANO-SUBSTITUTED PERYLENE-3,4-DICARBOXYLIC ACID MONOIMIDES BASF AKTIENGESELLSCHAFT (DE) 2005-06-22 EP disclosed
EP-1532210-A1 RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2005-05-25 EP disclosed
EP-1513841-A1 1,6,9,14-TETRASUBSTITUTED TERRYLENE TETRACARBOXYLIC ACID DIIMIDES BASF AKTIENGESELLSCHAFT (DE) 2005-03-16 EP disclosed
WO-2004029028-A2 9-CYANO-SUBSTITUTED PERYLENE-3,4-DICARBOXYLIC ACID MONOIMIDES AS DYESTUFFS BASF AKTIENGESELLSCHAFT (DE) 2004-04-08 WO disclosed
WO-2004026965-A1 RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2004-04-01 WO disclosed
EP-1373214-A1 RYLENE DERIVATIVES AND THEIR USE AS DYES BASF AKTIENGESELLSCHAFT (DE) 2004-01-02 EP disclosed
WO-2003104232-A1 1,6,9,14-TETRASUBSTITUTED TERRYLENE TETRACARBOXYLIC ACID DIIMIDES BASF AKTIENGESELLSCHAFT (DE) 2003-12-18 WO disclosed
EP-1370612-A2 THERMOCHROMIC RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2003-12-17 EP disclosed
WO-2002068538-A2 THERMOCHROMIC RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2002-09-06 WO disclosed
WO-2002066438-A1 RYLENE DERIVATIVES AND THEIR USE AS DYES BASF AKTIENGESELLSCHAFT (DE) 2002-08-29 WO disclosed
EP-1206456-A1 THERMOCHROMIC RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2002-05-22 EP disclosed
WO-2001016109-A1 THERMOCHROMIC RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2001-03-08 WO disclosed