SCHEMBL4649018

SCHEMBL4649018

Cc1ccc(N=C(S)C=CSc2cccc(Cl)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
MEN1 O00255 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
KMT2A Q03164 1/20 0.35
RELA Q04206 1/20 0.35
CRHR1 P34998 1/20 0.34
HPGD P15428 1/20 0.33
NOS3 P29474 4/20 0.33
NOS1 P29475 4/20 0.33
NOS2 P35228 4/20 0.33
HTR3E A5X5Y0 2/20 0.32
SLC22A2 O15244 2/20 0.32
SLC22A1 O15245 2/20 0.32
SLC22A3 O75751 2/20 0.32
HTR3B O95264 2/20 0.32
PLAU P00749 2/20 0.32

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
SCHEMBL4646831 0.88 LMNA (0.40) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4646879 0.85 NFE2L2 (0.36) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4647805 0.85 MAPT (0.35) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4647939 0.84 ALDH1A1 (0.41) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4646104 0.84 MAPT (0.50) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4649053 0.82 HTR3E (0.37) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4647027 0.82 MAPT (0.46) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4648580 0.80 LMNA (0.38) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4646923 0.80 HTR3E (0.44) MAPTALDH1A1LMNANPSR1MEN1
SCHEMBL4646000 0.78 ALDH1A1 (0.54) MAPTALDH1A1LMNANPSR1MEN1

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-1957459-A2 IMINOPROPENE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-08-20 EP disclosed
WO-2007063702-A2 IMINOPROPENE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-07 WO disclosed