SCHEMBL4645248

SCHEMBL4645248

O=C(/C=C/Sc1ccc(Cl)c(Cl)c1)NSc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.43
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
NPSR1 Q6W5P4 3/20 0.43
HTT P42858 2/20 0.41
PLIN1 O60240 1/20 0.41
HPGD P15428 1/20 0.41
PLIN5 Q00G26 1/20 0.41
ABHD5 Q8WTS1 1/20 0.41
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
PTGER1 P34995 2/20 0.35
PTGER3 P43115 2/20 0.35
PTGER2 P43116 2/20 0.35
HDAC3 O15379 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
SCHEMBL4646825 0.85 MAPT (0.47) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4645164 0.83 MAPT (0.48) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4648534 0.81 MAPT (0.41) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4648389 0.80 MAPT (0.42) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4648358 0.79 ITGB2 (0.44) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4648491 0.79 ALDH1A1 (0.47) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4647175 0.75 NPSR1 (0.40) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4646887 0.71 EPHX1 (0.44) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4644533 0.69 MMP1 (0.61) LMNAMAPTALDH1A1NPSR1HTT
SCHEMBL4645251 0.69 NPSR1 (0.35) LMNAMAPTALDH1A1NPSR1HTT

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