SCHEMBL28078005

SCHEMBL28078005

CCCC=COc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 5/20 0.42
TSHR P16473 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
CA4 P22748 1/20 0.36
AOC3 Q16853 1/20 0.34
TRPA1 O75762 1/20 0.34
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KCNA3 P22001 1/20 0.33
MAPT P10636 1/20 0.33
ALOX12 P18054 1/20 0.33

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
SCHEMBL8601466 0.85 LTA4H (0.47) LTA4HLMNAHTTSMN1; SMN2
SCHEMBL28710286 0.85 LTA4H (0.47) LTA4HLMNAHTTSMN1; SMN2
SCHEMBL31106429 0.85 LTA4H (0.47) LTA4HLMNAHTTSMN1; SMN2
SCHEMBL29653962 0.83 LTA4H (0.46) LTA4HLMNAHTTSMN1; SMN2
SCHEMBL10948621 0.83 LTA4H (0.43) LTA4HTSHRL3MBTL1LMNAHTT
SCHEMBL5513094 0.83 LTA4H (0.43) LTA4HTSHRL3MBTL1LMNAHTT
SCHEMBL14887362 0.82 ACHE (0.38) TSHRL3MBTL1LMNARELAMAPT
SCHEMBL11742595 0.81 EPHX2 (0.39) LTA4HTSHRL3MBTL1LMNAHTT
SCHEMBL30071999 0.80 CA4 (0.38) LTA4HTSHRL3MBTL1CA4AOC3
SCHEMBL14315899 0.80 SMN1; SMN2 (0.42) L3MBTL1LMNAHTTSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105778503-A Flame-retardant textile material and preparation method thereof 吴江市泽旺纺织有限公司 2016-07-20 CN disclosed