SCHEMBL4708549

SCHEMBL4708549

CC(CNCc1ccccc1NC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
KDM4E B2RXH2 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HPGD P15428 1/20 0.54
HSD17B10 Q99714 1/20 0.54
KMT2A Q03164 4/20 0.50
MEN1 O00255 1/20 0.50
NPSR1 Q6W5P4 3/20 0.47
PKM P14618 2/20 0.46
LMNA P02545 4/20 0.45
GAA P10253 1/20 0.43
POLB P06746 2/20 0.43
CNR1 P21554 1/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42

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 0.93 KMT2A (0.49) ALDH1A1KDM4ESMN1; SMN2HPGDHSD17B10
SCHEMBL4707004 0.92 KMT2A (0.49) ALDH1A1KDM4ESMN1; SMN2HPGDHSD17B10
SCHEMBL4709973 0.86 MAPT (0.45) ALDH1A1KDM4ESMN1; SMN2KMT2ALMNA
SCHEMBL4707120 0.84 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2HPGDKMT2AMEN1
SCHEMBL4202147 0.83 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2HPGDHSD17B10
SCHEMBL4708567 0.83 KDM4E (0.46) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL4710157 0.82 KDM4E (0.51) ALDH1A1KDM4EHSD17B10NPSR1PKM
SCHEMBL4709049 0.81 LMNA (0.43) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL4708259 0.81 SMN1; SMN2 (0.51) ALDH1A1KDM4ESMN1; SMN2HSD17B10KMT2A
SCHEMBL4706421 0.80 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2HPGDHSD17B10

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