SCHEMBL304469

SCHEMBL304469

CC1CCCN(C(=O)c2ccc(N(Cc3ccccc3)S(=O)(=O)c3cn(C)cn3)cc2)C1.Cn1cnc(S(=O)(=O)N(Cc2ccccc2)c2ccc(C(=O)N3CCN(c4ccccc4F)CC3)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
POLB P06746 4/20 0.45
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALOX15 P16050 1/20 0.41
KMT2A Q03164 4/20 0.41
HPGD P15428 2/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 2/20 0.40
MEN1 O00255 3/20 0.39
NPSR1 Q6W5P4 1/20 0.38
ADRA1A P35348 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38

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
SCHEMBL3275527 0.91 LMNA (0.51) LMNAPOLBALDH1A1SMN1; SMN2HTT
SCHEMBL1710991 0.91 LMNA (0.47) LMNAALDH1A1SMN1; SMN2HTTKMT2A
SCHEMBL327423 0.86 POLB (0.46) LMNAPOLBALDH1A1SMN1; SMN2HTT
SCHEMBL303609 0.84 TP53 (0.46) LMNAPOLBALDH1A1SMN1; SMN2HTT
SCHEMBL302109 0.84 LMNA (0.47) LMNAPOLBALDH1A1SMN1; SMN2HTT
SCHEMBL3376397 0.83 KMT2A (0.50) LMNAPOLBALDH1A1SMN1; SMN2HTT
SCHEMBL1723221 0.83 GRM5 (0.49) LMNAPOLBALDH1A1SMN1; SMN2HTT
SCHEMBL1722401 0.82 KMT2A (0.55) LMNASMN1; SMN2HTTKMT2AHPGD
SCHEMBL304021 0.82 PROKR1 (0.49) LMNAALDH1A1SMN1; SMN2HTTKMT2A
SCHEMBL1722406 0.81 LMNA (0.58) LMNAPOLBSMN1; SMN2HTTKMT2A

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
WO-2010023445-A1 NOVEL POTASSIUM CHANNEL BLOCKER XENTION LIMITED (GB) 2010-03-04 WO claimed