SCHEMBL4707004

SCHEMBL4707004

Cc1ccc(S(=O)(=O)N2CCN(C(=O)Nc3ccccc3CNCC(C)C3CCCCC3)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
PKM P14618 3/20 0.49
MEN1 O00255 2/20 0.49
GAA P10253 3/20 0.49
ALDH1A1 P00352 6/20 0.48
NPSR1 Q6W5P4 2/20 0.45
LMNA P02545 3/20 0.45
USP2 O75604 2/20 0.45
PLA2G1B P04054 1/20 0.44
ATG4B Q9Y4P1 1/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
MDM2 Q00987 1/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
EPHX2 P34913 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL4706905 0.94 KMT2A (0.49) KMT2APKMMEN1GAAALDH1A1
SCHEMBL4708549 0.92 ALDH1A1 (0.54) KMT2APKMMEN1GAAALDH1A1
SCHEMBL4707120 0.85 ALDH1A1 (0.48) KMT2APKMMEN1GAAALDH1A1
SCHEMBL4708567 0.84 KDM4E (0.46) KMT2APKMMEN1GAAALDH1A1
SCHEMBL4190300 0.83 PKM (0.49) KMT2APKMMEN1GAAALDH1A1
SCHEMBL4708259 0.81 SMN1; SMN2 (0.51) KMT2AMEN1GAAALDH1A1LMNA
SCHEMBL4706421 0.81 ALDH1A1 (0.45) KMT2AMEN1GAAALDH1A1NPSR1
SCHEMBL4710157 0.81 KDM4E (0.51) PKMGAAALDH1A1NPSR1LMNA
SCHEMBL4709973 0.78 MAPT (0.45) KMT2AGAAALDH1A1LMNAKDM4E
SCHEMBL4705836 0.77 KMT2A (0.50) KMT2APKMMEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1879877-A2 ANTIMICROBIAL AGENTS Ranbaxy Laboratories Limited (IN) 2008-01-23 EP disclosed
WO-2006117762-A2 ANTIMICROBIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO disclosed