SCHEMBL4648358

SCHEMBL4648358

O=C(/C=C/Sc1ccc(Cl)cc1Cl)NSc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 10/20 0.44
ICAM1 P05362 10/20 0.44
ITGAL P20701 10/20 0.44
MAPT P10636 3/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 1/20 0.42
EGFR P00533 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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 0.87 MAPT (0.41) MAPTLMNAALDH1A1NPSR1MEN1
SCHEMBL4646825 0.83 MAPT (0.47) MAPTLMNAALDH1A1NPSR1MEN1
SCHEMBL4645164 0.81 MAPT (0.48) MAPTLMNAALDH1A1NPSR1MEN1
SCHEMBL4646887 0.79 EPHX1 (0.44) MAPTLMNAALDH1A1NPSR1MEN1
SCHEMBL4645248 0.79 LMNA (0.43) MAPTLMNAALDH1A1NPSR1MEN1
SCHEMBL4647175 0.79 NPSR1 (0.40) MAPTLMNAALDH1A1NPSR1MEN1
SCHEMBL4648389 0.72 MAPT (0.42) MAPTLMNAALDH1A1NPSR1MEN1
SCHEMBL4648491 0.71 ALDH1A1 (0.47) MAPTLMNAALDH1A1NPSR1MEN1
SCHEMBL4648361 0.68 ITGB2 (0.40) ITGB2ICAM1ITGALMAPTLMNA
SCHEMBL4646530 0.67 RAB9A (0.57) MAPTALDH1A1NPSR1MEN1KMT2A

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