SCHEMBL790249

SCHEMBL790249

CCCCCCCCCCCCCCOCC(CO)(COP(O)O)COP(O)O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.45
HTT P42858 2/20 0.43
MEN1 O00255 1/20 0.43
THRB P10828 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.43
USP2 O75604 1/20 0.39
CES2 O00748 2/20 0.38
TSHR P16473 1/20 0.34
PLA2G2C Q5R387 1/20 0.34
GBA2 Q9HCG7 10/20 0.33
GBA1 P04062 5/20 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
SCHEMBL7651329 1.00 CES1 (0.45) CES1HTTMEN1THRBKMT2A
SCHEMBL10596203 0.97 CES1 (0.45) CES1HTTMEN1THRBKMT2A
SCHEMBL625267 0.91 CES1 (0.49) CES1HTTMEN1THRBKMT2A
SCHEMBL11155708 0.88 CES1 (0.55) CES1HTTMEN1THRBKMT2A
SCHEMBL19463076 0.88 CES1 (0.55) CES1HTTMEN1THRBKMT2A
SCHEMBL1238411 0.88 CES1 (0.55) CES1HTTMEN1THRBKMT2A
SCHEMBL2018151 0.88 CES1 (0.55) CES1HTTMEN1THRBKMT2A
SCHEMBL4109335 0.88 CES1 (0.55) CES1HTTMEN1THRBKMT2A
SCHEMBL19463378 0.88 CES1 (0.55) CES1HTTMEN1THRBKMT2A
SCHEMBL31507425 0.88 CES1 (0.55) 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-2616473-B1 MIXTURES CONTAINING PHOSPHOROUS, PROCEDURES FOR THEIR PRODUCTION AND USE CLARIANT INT LTD (CH) 2016-11-09 EP disclosed
EP-2616473-A2 PHOSPHORUS-CONTAINING MIXTURES, PROCESSES FOR PREPARING THEM AND USE THEREOF Clariant Finance (BV) Limited (VG) 2013-07-24 EP disclosed
WO-2012034680-A2 PHOSPHORUS-CONTAINING MIXTURES, PROCESSES FOR PREPARING THEM AND USE THEREOF CLARIANT INTERNATIONAL LTD (CH) 2012-03-22 WO disclosed