SCHEMBL8440491

SCHEMBL8440491

N#Cc1c(N)cccc1Nc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 7/20 0.69
MAPK12 P53778 7/20 0.69
MAPK11 Q15759 7/20 0.69
MAPK14 Q16539 7/20 0.69
ALDH1A1 P00352 7/20 0.50
MAPT P10636 6/20 0.50
GAA P10253 4/20 0.50
HPGD P15428 4/20 0.48
HTT P42858 2/20 0.48
MAPK1 P28482 2/20 0.48
LMNA P02545 3/20 0.46
POLB P06746 1/20 0.46
KDM4E B2RXH2 3/20 0.43
THRB P10828 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
ALOX12 P18054 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL3978775 0.82 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL6654540 0.81 MAPK13 (0.68) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL27497826 0.79 MAPK13 (0.91) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL6658069 0.76 MAPK13 (0.78) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL6654831 0.76 MAPK13 (0.85) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL6655626 0.75 MAPK13 (0.56) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL6653092 0.73 MAPK13 (0.74) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL6652732 0.73 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL6655478 0.73 MAPK13 (0.74) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL27497518 0.73 MAPK13 (0.74) MAPK13MAPK12MAPK11MAPK14ALDH1A1

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-0966423-A1 HYDROXYMETHYL DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE AS CARDIOVASCULAR AGENT ZAMBON GROUP S.p.A. (IT) 1999-12-29 EP disclosed
EP-0966424-A1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 1999-12-29 EP disclosed
WO-1998038154-A1 HYDROXYMETHYL DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE AS CARDIOVASCULAR AGENT ZAMBON GROUP S.P.A. (IT) 1998-09-03 WO disclosed
WO-1998032730-A1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 1998-07-30 WO disclosed