SCHEMBL327423

SCHEMBL327423

CC1CCCN(C(=O)c2ccc(N(Cc3ccc(F)cc3)S(=O)(=O)c3cn(C)cn3)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
ALDH1A1 P00352 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
KMT2A Q03164 4/20 0.44
HPGD P15428 4/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
LMNA P02545 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NPC1 O15118 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
RECQL P46063 1/20 0.43
TP53 P04637 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
SCHEMBL303609 0.93 TP53 (0.46) POLBALDH1A1SMN1; SMN2CA12CA1
SCHEMBL1723221 0.92 GRM5 (0.49) POLBALDH1A1SMN1; SMN2CA12CA1
SCHEMBL1710991 0.92 LMNA (0.47) ALDH1A1SMN1; SMN2CA12CA1CA2
SCHEMBL303461 0.87 LMNA (0.43) POLBALDH1A1SMN1; SMN2KMT2AHPGD
SCHEMBL304469 0.86 LMNA (0.48) POLBALDH1A1SMN1; SMN2CA12CA1
SCHEMBL3275416 0.85 RAB9A (0.52) POLBALDH1A1SMN1; SMN2KMT2AHPGD
SCHEMBL302109 0.84 LMNA (0.47) POLBALDH1A1SMN1; SMN2KMT2AHPGD
SCHEMBL1722401 0.83 KMT2A (0.55) SMN1; SMN2KMT2AHPGDMEN1LMNA
SCHEMBL304021 0.83 PROKR1 (0.49) ALDH1A1SMN1; SMN2KMT2AHPGDMEN1
SCHEMBL1723280 0.82 KMT2A (0.49) POLBALDH1A1KMT2AHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2012500834-A 2012-01-12 JP claimed
EP-2344456-A1 NOVEL POTASSIUM CHANNEL BLOCKER Xention Limited (GB) 2011-07-20 EP claimed
EP-2344456-A1 NOVEL POTASSIUM CHANNEL BLOCKER Xention Limited (GB) 2011-07-20 EP disclosed