SCHEMBL4454143

SCHEMBL4454143

CCCOP(OCCC)c1ccccc1CCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2B P18089 4/20 0.33
ADRA2C P18825 4/20 0.33
ADRA2A P08913 3/20 0.33
PPARD Q03181 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HTR1A P08908 2/20 0.31
NISCH Q9Y2I1 1/20 0.31
DAO P14920 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
LTB4R Q15722 1/20 0.30
LTB4R2 Q9NPC1 1/20 0.30
LIPG Q9Y5X9 1/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL4450146 0.89 LTA4H (0.37) PPARDALDH1A1MEN1KMT2ALIPG
SCHEMBL4460496 0.89 LIPG (0.39) CYP4F2CYP4A11LIPG
SCHEMBL4455343 0.87 CYP4F2 (0.34) ADRA2BADRA2CADRA2APPARDHTR1A
SCHEMBL4452162 0.87 L3MBTL1 (0.38) ALDH1A1LMNAMEN1KMT2ACYP4F2
SCHEMBL4456016 0.82 LIPG (0.39) ALDH1A1LIPGL3MBTL1
SCHEMBL4462349 0.81 TSHR (0.35) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4451093 0.81 ADRA2A (0.34) ADRA2BADRA2CADRA2APPARDHTR1A
SCHEMBL4460772 0.76 PPARA (0.35) ADRA2BADRA2CADRA2APPARDPPARG
SCHEMBL4455991 0.76 LIPG (0.40) CYP4F2CYP4A11LIPG
SCHEMBL4461175 0.76 L3MBTL1 (0.40) ALDH1A1LMNAMEN1KMT2AMAPT

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 2 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