SCHEMBL366181

SCHEMBL366181

COC(=O)c1c2ccccc2n2cc([S+]([O-])CCCl)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
MEN1 O00255 2/20 0.41
NR4A2 P43354 4/20 0.40
GAA P10253 2/20 0.39
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
F2 P00734 1/20 0.36
PLAU P00749 1/20 0.36
ELANE P08246 1/20 0.36
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PKM P14618 1/20 0.35
BRD4 O60885 1/20 0.34
EGFR P00533 1/20 0.34
SRC P12931 1/20 0.34

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
SCHEMBL365899 0.89 LMNA (0.40) KMT2AMEN1NR4A2GAALMNA
SCHEMBL366188 0.87 NR4A2 (0.39) KMT2AMEN1NR4A2GAALMNA
SCHEMBL364533 0.83 NR4A2 (0.45) KMT2AMEN1NR4A2GAALMNA
SCHEMBL366180 0.83 MAPT (0.43) KMT2AMEN1GAALMNASMN1; SMN2
SCHEMBL364929 0.75 NR4A2 (0.41) KMT2AMEN1NR4A2GAALMNA
SCHEMBL367527 0.74 NR4A2 (0.41) KMT2AMEN1NR4A2GAALMNA
SCHEMBL364931 0.74 NR4A2 (0.50) KMT2AMEN1NR4A2GAALMNA
SCHEMBL364927 0.74 SRC (0.51) KMT2AMEN1NR4A2GAALMNA
SCHEMBL365565 0.73 KMT2A (0.52) KMT2AMEN1NR4A2GAALMNA
SCHEMBL365826 0.72 KMT2A (0.48) KMT2AMEN1NR4A2GAALMNA

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
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed