SCHEMBL2489162

SCHEMBL2489162

CN(C)c1ccsc1CC1CCC(CNC(=O)c2ccccc2N(C)S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
CHRM1 P11229 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
HTT P42858 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALPL P05186 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
CXCR3 P49682 1/20 0.38
GRM4 Q14833 1/20 0.38
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL2489904 0.88 KMT2A (0.45) KMT2AMEN1CHRM1L3MBTL1HTT
SCHEMBL644809 0.80 KMT2A (0.40) KMT2AMEN1CHRM1L3MBTL1HTT
SCHEMBL643252 0.79 KMT2A (0.42) KMT2AMEN1CHRM1L3MBTL1HTT
SCHEMBL2488173 0.78 HTT (0.46) KMT2AMEN1L3MBTL1HTTSMN1; SMN2
SCHEMBL643063 0.77 CXCR3 (0.42) KMT2AMEN1CHRM1L3MBTL1HTT
SCHEMBL642945 0.77 CXCR3 (0.43) KMT2AMEN1CHRM1L3MBTL1HTT
SCHEMBL644580 0.76 KMT2A (0.42) KMT2AMEN1CHRM1L3MBTL1HTT
SCHEMBL642958 0.70 KMT2A (0.43) KMT2AMEN1CHRM1HTTSMN1; SMN2
SCHEMBL645509 0.69 TDP1 (0.58) KMT2AMEN1LMNAKDM4EALDH1A1
SCHEMBL644868 0.69 KMT2A (0.44) KMT2AHTTSMN1; SMN2LMNAALDH1A1

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