SCHEMBL8526917

SCHEMBL8526917

CC(C)OC(=O)CC(C(=O)OC(C)C)S(=O)(=O)O.[NaH]

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.40
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.34
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
MMP13 P45452 1/20 0.32
PRKCA P17252 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CYP2D6 P10635 1/20 0.30

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
SCHEMBL4020730 0.98 RECQL (0.41) RECQLLMNATSHRMMP1MMP2
SCHEMBL9225353 0.85 RECQL (0.38) RECQLLMNATSHRMMP1MMP2
SCHEMBL8414912 0.85 MMP1 (0.40) RECQLLMNATSHRMMP1MMP2
SCHEMBL6692606 0.82 TSHR (0.34) RECQLLMNATSHRCA12CA1
SCHEMBL8526920 0.81 LMNA (0.34) LMNATSHRMMP1MMP2MMP3
Ammonia Solution, Strong SCHEMBL9225347 0.81 TSHR (0.33) RECQLLMNATSHRCA12CA1
SCHEMBL4385316 0.80 CYP19A1 (0.37) RECQLMMP1MMP2MMP3MMP9
SCHEMBL1257844 0.79 RECQL (0.39) RECQLMMP1MMP2MMP3MMP9
SCHEMBL11515087 0.79 CA12 (0.34) LMNATSHRCA12CA1CA2
SCHEMBL6128366 0.78 RECQL (0.44) RECQLMMP1MMP2MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635548-B1 Thermoplastic resin composition MITSUBISHI CHEM CORP (JP) 1998-03-11 EP claimed
EP-0635548-A1 Thermoplastic resin composition MITSUBISHI CHEMICAL CORPORATION (JP) 1995-01-25 EP claimed
EP-0635548-B1 Thermoplastic resin composition MITSUBISHI CHEM CORP (JP) 1998-03-11 EP disclosed
US-5541243-A Thermoplastic resin composition MITSUBISHI CHEMICAL CORPORATION (JP) 1996-07-30 US disclosed
EP-0635548-A1 Thermoplastic resin composition MITSUBISHI CHEMICAL CORPORATION (JP) 1995-01-25 EP disclosed