SCHEMBL8998738

SCHEMBL8998738

CC(C)CCCCCSCCC(=O)[O-].CC(C)CCCCCSCCC(=O)[O-].CCCC[Sn+2]Cl

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.39
CA1 P00915 5/20 0.38
NFKB1 P19838 1/20 0.37
CA2 P00918 3/20 0.35
CES2 O00748 1/20 0.33
GMNN O75496 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
CYP2C9 P11712 1/20 0.33
BLM P54132 1/20 0.33
HSD17B10 Q99714 1/20 0.33
BHMT Q93088 1/20 0.32
FABP3 P05413 3/20 0.32

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
SCHEMBL8501640 0.89 GPR84 (0.41) GPR84CA1NFKB1CA2CES2
SCHEMBL3681094 0.88 CES2 (0.41) GPR84CA1NFKB1CA2CES2
SCHEMBL11600712 0.86 CA1 (0.44) GPR84CA1NFKB1CA2BHMT
SCHEMBL748704 0.83 CA1 (0.47) GPR84CA1NFKB1CA2BHMT
SCHEMBL17472939 0.83 CA1 (0.50) GPR84CA1NFKB1CA2BHMT
SCHEMBL10592362 0.83 CA1 (0.50) GPR84CA1NFKB1CA2BHMT
SCHEMBL3715599 0.82 GPR84 (0.42) GPR84CA1NFKB1CA2CES2
SCHEMBL8998741 0.80 EPHX1 (0.44) GPR84CA1CA2
SCHEMBL749231 0.77 CES2 (0.42) GPR84CA1NFKB1CA2CES2
SCHEMBL7625556 0.76 CES2 (0.41) GPR84CA1NFKB1CA2CES2

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
EP-0483400-B1 Stabilized chlorinated resin composition ASAHI DENKA KOGYO KK (JP) 1996-09-11 EP disclosed
US-5356981-A An inorganic copper compound adsorbed into hydrotalcite; polyvinyl chloride ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1994-10-18 US disclosed
EP-0483400-A1 Stabilized chlorinated resin composition ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1992-05-06 EP disclosed
US-4371656-A Metal substituted zeolites as stabilizers for halogen-containing resins NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 1983-02-01 US disclosed