SCHEMBL11213537

SCHEMBL11213537

CCCCCCCCCCCCCCCCCCOCC(C)(C)CO.OP(O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.49
HTT P42858 2/20 0.47
MEN1 O00255 1/20 0.47
THRB P10828 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 1/20 0.47
USP2 O75604 1/20 0.42
CES2 O00748 2/20 0.41
TSHR P16473 1/20 0.38
GBA2 Q9HCG7 10/20 0.35
GBA1 P04062 5/20 0.35

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
SCHEMBL11211887 1.00 CES1 (0.49) CES1HTTMEN1THRBKMT2A
SCHEMBL11209987 0.94 CES1 (0.53) CES1HTTMEN1THRBKMT2A
SCHEMBL10993366 0.94 CES1 (0.53) CES1HTTMEN1THRBKMT2A
SCHEMBL28385756 0.94 CES1 (0.53) CES1HTTMEN1THRBKMT2A
SCHEMBL7035407 0.94 CES1 (0.53) CES1HTTMEN1THRBKMT2A
SCHEMBL10986732 0.92 CES1 (0.50) CES1HTTMEN1THRBKMT2A
SCHEMBL2349435 0.90 CES1 (0.48) CES1HTTMEN1THRBKMT2A
SCHEMBL9023823 0.86 TSHR (0.50) CES1HTTMEN1THRBKMT2A
SCHEMBL27829650 0.83 CES1 (0.50) CES1HTTMEN1THRBKMT2A
SCHEMBL28138332 0.83 CES1 (0.50) CES1HTTMEN1THRBKMT2A

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-0019349-B1 STABILIZING COMPOSITION FOR POLYARYLENE ESTERS, STABILIZED POLYARYLENE ESTER, MOULDED ARTICLE PRODUCED THEREFROM AND PROCESS FOR STABILIZING A POLYARYLENE ESTER MONSANTO COMPANY (US) 1983-08-03 EP disclosed
EP-0019349-A1 Stabilizing composition for polyarylene esters, stabilized polyarylene ester, moulded article produced therefrom and process for stabilizing a polyarylene ester MONSANTO COMPANY (US) 1980-11-26 EP disclosed
US-4222932-A MOLDING MATERIALS STABILIZED BY ADDING AN AROMATIC ISOCYANATE AND AN ALIPHATIC PHOSPHITE MONSANTO COMPANY (US) 1980-09-16 US disclosed