SCHEMBL3315873

SCHEMBL3315873

CCCCCCCCCCCCCCCCCCc1c(O)cc2ccccc2c1C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 3/20 0.43
GAA P10253 2/20 0.41
USP2 O75604 1/20 0.41
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
KAT8 Q9H7Z6 4/20 0.41
BID P55957 3/20 0.41
MCL1 Q07820 3/20 0.41
BCL2L1 Q07817 2/20 0.41
BAK1 Q16611 2/20 0.41
PPARA Q07869 2/20 0.41
PPARG P37231 1/20 0.41
EP300 Q09472 1/20 0.41
KAT2A Q92830 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
SCHEMBL3316307 1.00 MAPT (0.45) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL3312529 1.00 MAPT (0.45) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL3316494 0.89 KDM4E (0.41) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL5968378 0.83 MAPT (0.46) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL10684176 0.80 KAT8 (0.51) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7107682 0.80 KAT8 (0.51) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL11221674 0.80 MAPT (0.47) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL28835732 0.80 TLR8 (0.47) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL10970707 0.79 KDM4E (0.49) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7731575 0.79 POLB (0.49) MAPTKDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010015586-A2 2,3,4,7-TETRAHYDRO-INDOLO[2,3-C]QUINOLINE COMPOUNDS NYCOMED GMBH (DE) 2010-02-11 WO disclosed