SCHEMBL9801523

SCHEMBL9801523

CCOc1ccc(C([SiH3])CCc2ccc(F)c(Oc3ccccc3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CACNA1C Q13936 1/20 0.36
CNR2 P34972 1/20 0.36
KAT6A Q92794 1/20 0.35
MAPT P10636 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL5081296 0.85 LTA4H (0.42) LTA4HMEN1KMT2ANPSR1SLC6A2
SCHEMBL10549602 0.83 LTA4H (0.42) LTA4HMEN1KMT2ANPSR1SLC6A2
SCHEMBL407786 0.82 LTA4H (0.41) LTA4HMEN1KMT2ANPSR1SLC6A2
SCHEMBL10549349 0.82 LTA4H (0.41) LTA4HMEN1KMT2ANPSR1LMNA
SCHEMBL10650344 0.80 LTA4H (0.39) LTA4HMEN1KMT2ANPSR1SLC6A2
SCHEMBL10652023 0.80 LTA4H (0.39) LTA4HMEN1KMT2ANPSR1SLC6A2
SCHEMBL8846649 0.79 LTA4H (0.43) LTA4HMEN1KMT2ASLC6A2SLC6A4
SCHEMBL6506489 0.79 SIGMAR1 (0.46) LTA4HCACNA1CTDP1
SCHEMBL7929051 0.78 LTA4H (0.53) LTA4HMEN1KMT2ASLC6A2SLC6A4
SCHEMBL9331962 0.78 LTA4H (0.43) LTA4HMEN1KMT2ASLC6A2SLC6A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2172993-A None JP disclosed
JP-3099003-A None JP disclosed
JP-H0399003-A TERMITE-CONTROLLING AGENT DAINIPPON JOCHUGIKU CO LTD 1991-04-24 JP disclosed
JP-H02172993-A MOTH-PROOFING AGENT DAINIPPON JOCHUGIKU CO LTD 1990-07-04 JP disclosed