SCHEMBL11791985

SCHEMBL11791985

Nc1cc(C(=O)c2ccc(Nc3ccccc3)c(N)c2)ccc1Nc1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 10/20 0.81
KDM4E B2RXH2 8/20 0.81
MAPT P10636 7/20 0.81
ALDH1A1 P00352 6/20 0.81
HSD17B10 Q99714 3/20 0.81
THRB P10828 2/20 0.81
HPGD P15428 2/20 0.81
MAPK13 O15264 6/20 0.66
MAPK12 P53778 6/20 0.66
MAPK11 Q15759 6/20 0.66
MAPK14 Q16539 6/20 0.66
GFER P55789 5/20 0.60
NPC1 O15118 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.56
GLA P06280 1/20 0.56
RCE1 Q9Y256 1/20 0.56
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
LMNA P02545 1/20 0.53

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
SCHEMBL4286847 0.97 GAA (0.77) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL10817421 0.91 GAA (0.68) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL2342942 0.90 GAA (1.00) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL6653594 0.89 MAPK13 (0.70) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL6656861 0.87 GAA (0.82) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL7989959 0.87 GAA (0.77) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL4002584 0.84 GAA (0.72) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL11798862 0.84 MAPK13 (0.72) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL9683164 0.83 GAA (0.70) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL26500555 0.83 GAA (0.70) GAAKDM4EMAPTALDH1A1HSD17B10

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
US-3951920-A Permselective polymeric membrane prepared from polybenzimidazoles TEIJIN LIMITED (JA) 1976-04-20 US disclosed