SCHEMBL13069976

SCHEMBL13069976

Cc1cc(F)cc(F)c1N1COc2ccc(F)cc2C1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RIPK1 Q13546 1/20 0.36
ROS1 P08922 1/20 0.31
ALK Q9UM73 1/20 0.31
KCNQ2 O43526 1/20 0.31
HTR3E A5X5Y0 1/20 0.30
HTR3B O95264 1/20 0.30
HTR3A P46098 1/20 0.30
HTR3D Q70Z44 1/20 0.30
HTR3C Q8WXA8 1/20 0.30
NTRK1 P04629 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
SCHEMBL10020832 0.90 RIPK1 (0.37) GAAMAPTSMN1; SMN2RIPK1HTR3E
SCHEMBL13863766 0.86 MAPT (0.39) GAAMAPTSMN1; SMN2RIPK1ROS1
SCHEMBL12690260 0.83 GAA (0.33) GAAMAPTSMN1; SMN2
SCHEMBL10020840 0.79 GAA (0.38) GAAMAPTSMN1; SMN2RIPK1
SCHEMBL10020844 0.77 HRH3 (0.33) GAAMAPTSMN1; SMN2RIPK1
SCHEMBL10020836 0.75 MAOB (0.40) GAAMAPTSMN1; SMN2RIPK1
SCHEMBL10020846 0.75
SCHEMBL12015730 0.74 GAA (0.31) GAAMAPTSMN1; SMN2
SCHEMBL5958804 0.74
SCHEMBL10020830 0.74

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
EP-2056390-B1 Electrolyte membrane for fuel cell and fuel cell using the same SAMSUNG ELECTRONICS CO LTD (KR) 2010-11-24 EP disclosed