SCHEMBL4451093

SCHEMBL4451093

CCCc1ccccc1P(OC)OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 4/20 0.34
ADRA2B P18089 4/20 0.34
ADRA2C P18825 4/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PPARD Q03181 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
HTR1A P08908 2/20 0.33
NISCH Q9Y2I1 1/20 0.33
DAO P14920 1/20 0.33
HMGCR P04035 1/20 0.32
ALOX5 P09917 1/20 0.32
PTGS2 P35354 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
PPARG P37231 1/20 0.31
PPARA Q07869 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
SCHEMBL4453663 0.89 LIPG (0.41) ALOX5PTGS2CYP4F2CYP4A11LIPG
SCHEMBL4460493 0.83 GABRA1 (0.38) KMT2ASMN1; SMN2CYP4F2CYP4A11PPARG
SCHEMBL4455343 0.82 CYP4F2 (0.34) ADRA2AADRA2BADRA2CMEN1GAA
SCHEMBL4454143 0.81 ADRA2B (0.33) ADRA2AADRA2BADRA2CMEN1KMT2A
SCHEMBL4460772 0.79 PPARA (0.35) ADRA2AADRA2BADRA2CSMN1; SMN2PPARD
SCHEMBL5988509 0.79 DAO (0.36) ADRA2AADRA2BADRA2CGAATAAR1
SCHEMBL4450146 0.78 LTA4H (0.37) MEN1KMT2APPARDLIPG
SCHEMBL4456095 0.77 ADRA2A (0.33) ADRA2AADRA2BADRA2CHTR1ANISCH
SCHEMBL18966266 0.75 CA1 (0.38) ADRA2BMEN1KMT2ASMN1; SMN2
SCHEMBL4451703 0.74 ADRA2A (0.32) ADRA2AADRA2BADRA2CHTR1ANISCH

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