SCHEMBL2489904

SCHEMBL2489904

CN(C)c1ccccc1CC1CCC(CNC(=O)c2ccccc2N(C)S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.45
CHRM1 P11229 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 4/20 0.42
HTT P42858 3/20 0.42
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.41
USP2 O75604 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GAA P10253 3/20 0.41
NPC1 O15118 1/20 0.40
CXCR3 P49682 1/20 0.39
ADAM17 P78536 1/20 0.39

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
SCHEMBL2488173 0.89 HTT (0.46) KMT2AMEN1L3MBTL1LMNAHTT
SCHEMBL2489162 0.88 KMT2A (0.41) KMT2AMEN1CHRM1L3MBTL1LMNA
SCHEMBL643252 0.83 KMT2A (0.42) KMT2AMEN1CHRM1L3MBTL1LMNA
SCHEMBL642945 0.82 CXCR3 (0.43) KMT2AMEN1CHRM1L3MBTL1LMNA
SCHEMBL643063 0.81 CXCR3 (0.42) KMT2AMEN1CHRM1L3MBTL1LMNA
SCHEMBL644580 0.80 KMT2A (0.42) KMT2AMEN1CHRM1L3MBTL1LMNA
SCHEMBL644809 0.80 KMT2A (0.40) KMT2AMEN1CHRM1L3MBTL1LMNA
SCHEMBL3666768 0.77 KMT2A (0.43) KMT2AMEN1ALPLALPIALPG
SCHEMBL2490288 0.74 CACNA1H (0.43) KMT2AL3MBTL1LMNAALDH1A1GAA
SCHEMBL642958 0.73 KMT2A (0.43) KMT2AMEN1CHRM1LMNAHTT

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
EP-2150530-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2011-10-26 EP claimed