SCHEMBL4752355

SCHEMBL4752355

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc3c(n2)CCN(C(=O)OCc2ccccc2)C3)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNA1 Q09470 4/20 0.49
KCNAB1 Q14722 4/20 0.49
DHFR P00374 1/20 0.47
MAP3K5 Q99683 3/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.44
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
TMEM97 Q5BJF2 3/20 0.43
SIGMAR1 Q99720 3/20 0.43
HPN P05981 1/20 0.42
ST14 Q9Y5Y6 1/20 0.42
F13A1 P00488 1/20 0.41
TGM2 P21980 1/20 0.41
TGM1 P22735 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL4753862 0.86 KCNA1 (0.65) KCNA1KCNAB1KDM4ELMNAALDH1A1
SCHEMBL4753834 0.84 KCNA1 (0.51) KCNA1KCNAB1KDM4ELMNAALDH1A1
SCHEMBL13983989 0.83 KCNA1 (0.66) KCNA1KCNAB1KDM4ELMNAALDH1A1
SCHEMBL4753275 0.81 KCNA1 (0.53) KCNA1KCNAB1KDM4ELMNAALDH1A1
SCHEMBL13983859 0.79 KCNA1 (0.52) KCNA1KCNAB1KDM4ELMNAALDH1A1
SCHEMBL4751184 0.78 KDM4E (0.52) KCNA1KCNAB1KDM4ELMNACA1
Ammonia Solution, Strong SCHEMBL4811566 0.77 KDM4E (0.51) KCNA1KCNAB1KDM4ELMNACA1
SCHEMBL4753300 0.73 ALDH1A1 (0.45) KDM4ELMNAALDH1A1HPGD
SCHEMBL28565628 0.73 ALDH1A1 (0.60) LMNACA1CA2TMEM97SIGMAR1
SCHEMBL23854680 0.73 DHFR (0.60) DHFRTMEM97SIGMAR1

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
WO-2008149163-A2 POTASSIUM ION CHANNEL MODULATORS AND USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2008-12-11 WO claimed
WO-2008149163-A2 POTASSIUM ION CHANNEL MODULATORS AND USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2008-12-11 WO disclosed
WO-2008149163-A2 POTASSIUM ION CHANNEL MODULATORS AND USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2008-12-11 WO disclosed