SCHEMBL366056

SCHEMBL366056

FCC(F)Oc1cccnc1Br

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 1/20 0.41
TRIM24 O15164 1/20 0.34
TRIM33 Q9UPN9 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 2/20 0.33
KDM4E B2RXH2 2/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
TRPV4 Q9HBA0 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31

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
SCHEMBL5582741 0.82 S1PR4 (0.40) S1PR4TRIM24TRIM33NPC1RAB9A
SCHEMBL30020489 0.82 S1PR4 (0.41) S1PR4TRIM24TRIM33NPC1RAB9A
SCHEMBL68709 0.82 S1PR4 (0.41) S1PR4TRIM24TRIM33NPC1RAB9A
SCHEMBL31651666 0.76 S1PR4 (0.50) S1PR4TRIM24TRIM33NPC1RAB9A
SCHEMBL25791866 0.75 S1PR4 (0.46) S1PR4TRIM24TRIM33NPC1RAB9A
SCHEMBL2861434 0.74 MEN1 (0.46) S1PR4TRIM24TRIM33SMN1; SMN2LMNA
SCHEMBL9980697 0.73 S1PR4 (0.55) S1PR4TRIM24TRIM33NPC1RAB9A
SCHEMBL25794980 0.72 S1PR4 (0.44) S1PR4TRIM24TRIM33NPC1RAB9A
SCHEMBL5582737 0.69 S1PR4 (0.41) S1PR4TRIM24TRIM33NPC1RAB9A
SCHEMBL30640674 0.69 S1PR4 (0.41) S1PR4TRIM24TRIM33NPC1RAB9A

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-2593432-A1 N-SULFONYLBENZAMIDE DERIVATIVES USEFUL AS VOLTAGE GATED SODIUM CHANNEL INHIBITORS Pfizer Limited (GB) 2013-05-22 EP disclosed
WO-2012007861-A1 N-SULFONYLBENZAMIDE DERIVATIVES USEFUL AS VOLTAGE GATED SODIUM CHANNEL INHIBITORS PFIZER LIMITED (GB) 2012-01-19 WO disclosed