Methane

Methane

SCHEMBL2581414

C.O=C(Nc1ccccc1)Nc1cccc(C(=O)c2ccc(Nc3ccc(F)cc3F)cc2Cl)c1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.54
NPC1 O15118 4/20 0.54
RAB9A P51151 3/20 0.54
HTT P42858 2/20 0.54
MAPK14 Q16539 3/20 0.51
MAPK13 O15264 2/20 0.51
MAPK12 P53778 2/20 0.51
MAPK11 Q15759 2/20 0.51
GAA P10253 1/20 0.47
CBS P35520 1/20 0.46
CNR1 P21554 1/20 0.46
KDM4E B2RXH2 1/20 0.46
KLK7 P49862 1/20 0.46
LMNA P02545 3/20 0.45
GRIK1 P39086 1/20 0.44
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GRM4 Q14833 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
SCHEMBL2199352 0.85 MAPK13 (0.63) SMN1; SMN2NPC1RAB9AHTTMAPK14
SCHEMBL2581412 0.83 MAPK13 (0.58) SMN1; SMN2NPC1RAB9AHTTMAPK14
SCHEMBL2199284 0.78 MAPT (0.59) SMN1; SMN2NPC1RAB9AHTTMAPK14
SCHEMBL2197054 0.77 MAPK13 (0.55) MAPK14MAPK13MAPK12MAPK11GRIK1
SCHEMBL2203132 0.76 MAPK13 (0.54) SMN1; SMN2NPC1RAB9AMAPK14MAPK13
SCHEMBL2199250 0.75 NPC1 (0.59) SMN1; SMN2NPC1RAB9AHTTMAPK14
SCHEMBL2200476 0.75 MAPK13 (0.57) NPC1RAB9AMAPK14MAPK13MAPK12
SCHEMBL5753034 0.75 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL2203090 0.74 MAPK13 (0.59) SMN1; SMN2NPC1RAB9AMAPK14MAPK13
SCHEMBL2199258 0.74 MAPK14 (0.55) SMN1; SMN2NPC1RAB9AMAPK14MAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658263-B9 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2011-11-09 EP claimed
EP-1658263-B1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2010-06-02 EP claimed