SCHEMBL8735848

SCHEMBL8735848

CC(OC(=O)O)C(C)(C)CO

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.32
KCNH2 Q12809 1/20 0.32
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 0.31

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
SCHEMBL17353390 0.84 PTGS1 (0.33) PTGS1KCNH2PRKCA
SCHEMBL607856 0.75 TSHR (0.33) MMP1MMP2MMP3MMP9MMP13
SCHEMBL10519096 0.71 TSHR (0.31)
SCHEMBL14762936 0.71 TSHR (0.31)
SCHEMBL19262679 0.71 TSHR (0.31)
SCHEMBL16754719 0.71 TSHR (0.31)
SCHEMBL8732964 0.71 CHRM1 (0.35) PRKCA
SCHEMBL14433371 0.70
SCHEMBL16326346 0.70
SCHEMBL14980245 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0638541-B1 Process for the production of dialkyl carbonate MITSUBISHI GAS CHEMICAL CO (JP) 1998-04-15 EP disclosed
US-5489702-A Process for the production of dialkyl carbonate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1996-02-06 US disclosed
EP-0638541-A1 Process for the production of dialkyl carbonate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-02-15 EP disclosed