SCHEMBL4451195

SCHEMBL4451195

CCCOP(=O)(CCO)OCCC

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.67
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP3A4 P08684 2/20 0.36
LPAR3 Q9UBY5 3/20 0.35
LPAR1 Q92633 2/20 0.35
LPAR2 Q9HBW0 2/20 0.35
TSHR P16473 2/20 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
SCHEMBL4462568 0.86 PPARD (0.61) PPARDCYP3A4LPAR3LPAR1LPAR2
SCHEMBL4451725 0.85 PPARD (0.48) PPARDMEN1KMT2ACYP3A4LPAR3
SCHEMBL28292031 0.83 PPARD (0.47) PPARDMEN1KMT2ACYP3A4LPAR3
SCHEMBL2780867 0.83 LPAR3 (0.59) PPARDMEN1KMT2ACYP3A4LPAR3
SCHEMBL15250938 0.83 PPARD (0.47) PPARDMEN1KMT2ACYP3A4LPAR3
SCHEMBL575421 0.82 PPARD (0.42) PPARDMEN1KMT2ACYP3A4LPAR3
SCHEMBL11133287 0.82 PPARD (0.61) PPARDMEN1KMT2ATSHR
SCHEMBL11237356 0.81 PPARD (0.54) PPARDMEN1KMT2ACYP3A4LPAR3
SCHEMBL2477131 0.80 PPARD (0.41) PPARDMEN1KMT2ACYP3A4LPAR3
SCHEMBL993811 0.80 PPARD (1.00) PPARDTSHR

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
US-7612148-B2 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2009-11-03 US disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed
US-4022757-A Dicarbamic acid diesters containing phosphorus BAYER AKTIENGESELLSCHAFT (DT) 1977-05-10 US disclosed