SCHEMBL14580986

SCHEMBL14580986

CCCSc1ccc(SCCC)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 12/20 0.56
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ FGB P02675 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ S100A4 P26447 5/20 0.45
▸ CDC25A P30304 4/20 0.44
▸ CDC25B P30305 4/20 0.44
▸ MAP2K7 O14733 3/20 0.44
▸ PTGS2 P35354 1/20 0.42
▸ MAPT P10636 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ APAF1 O14727 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ GMNN O75496 1/20 0.42
▸ TDP2 O95551 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ PLA2G1B P04054 1/20 0.42

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
SCHEMBL6365364 0.85 SOAT1 (0.47) SOAT1MEN1KMT2AFGBPOLB
SCHEMBL8677938 0.81 MEN1 (0.54) SOAT1MEN1KMT2AFGBPOLB
SCHEMBL10581743 0.78 SOAT1 (0.54) SOAT1MEN1KMT2AFGBPOLB
SCHEMBL10894890 0.77 SOAT1 (0.55) SOAT1MEN1KMT2AFGBPOLB
SCHEMBL23388947 0.76 SOAT1 (0.56) SOAT1MEN1KMT2AFGBPOLB
SCHEMBL29886439 0.76 SOAT1 (0.56) SOAT1MEN1KMT2AFGBPOLB
SCHEMBL17249980 0.74 CDC25B (0.73) SOAT1MEN1KMT2AS100A4CDC25A
SCHEMBL15347539 0.74 SOAT1 (0.42) SOAT1MEN1KMT2AFGBPOLB
SCHEMBL11391072 0.74 SOAT1 (0.44) SOAT1S100A4PTGS2ALDH1A1TDP1
SCHEMBL7855715 0.73 SOAT1 (0.52) SOAT1S100A4PTGS2

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
US-20070032598-A1 Thermally stable, anthraquinone colorants containing copolymerizable vinyl groups CYR MICHAEL J 2007-02-08 — — US disclosed
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