SCHEMBL4647175

SCHEMBL4647175

Cc1ccccc1S/C=C/C(=O)NSc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 3/20 0.40
HPGD P15428 2/20 0.40
PLIN1 O60240 1/20 0.40
HTT P42858 1/20 0.40
PLIN5 Q00G26 1/20 0.40
ABHD5 Q8WTS1 1/20 0.40
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
EGFR P00533 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL4648534 0.86 MAPT (0.41) NPSR1MAPTALDH1A1LMNAHPGD
SCHEMBL4649042 0.79 MMP1 (0.49) NPSR1MAPTALDH1A1HPGDKMT2A
SCHEMBL4649040 0.79 MMP1 (0.49) NPSR1MAPTALDH1A1HPGDKMT2A
SCHEMBL4648358 0.79 ITGB2 (0.44) NPSR1MAPTALDH1A1LMNAHTT
SCHEMBL6946687 0.78 NPSR1 (0.42) NPSR1MAPTALDH1A1LMNAHPGD
SCHEMBL6946681 0.78 NPSR1 (0.42) NPSR1MAPTALDH1A1LMNAHPGD
SCHEMBL4645164 0.77 MAPT (0.48) NPSR1MAPTALDH1A1LMNAHPGD
SCHEMBL4646825 0.76 MAPT (0.47) NPSR1MAPTALDH1A1LMNAHPGD
SCHEMBL4648491 0.75 ALDH1A1 (0.47) NPSR1MAPTALDH1A1LMNAHPGD
SCHEMBL4645248 0.75 LMNA (0.43) NPSR1MAPTALDH1A1LMNAHPGD

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