SCHEMBL6236466

SCHEMBL6236466

COc1cc(OCc2c(F)cccc2Cl)cc(OC)c1CNCc1sccc1C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.40
CD274 Q9NZQ7 5/20 0.38
HTT P42858 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GNRHR P30968 1/20 0.37

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
SCHEMBL12642510 0.92 KMT2A (0.48) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6233698 0.90 SMN1; SMN2 (0.42) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6236017 0.84 SMN1; SMN2 (0.46) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6234217 0.81 SMN1; SMN2 (0.49) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6233547 0.78 SMN1; SMN2 (0.44) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6260267 0.78 SMN1; SMN2 (0.44) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6254258 0.77 SMN1; SMN2 (0.45) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6236777 0.76 SMN1; SMN2 (0.46) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6238955 0.73 SMN1; SMN2 (0.47) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL6232102 0.72 CTSA (0.44) CD274

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-2005000309-A2 CHEMICAL COMPOUNDS IONIX PHARMACEUTICALS LIMITED (GB) 2005-01-06 WO disclosed