SCHEMBL6234480

SCHEMBL6234480

CCCCOCC(O)(O)OCCCC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.47
TSHR P16473 2/20 0.44
HTT P42858 2/20 0.35
MEN1 O00255 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35
CYP3A4 P08684 2/20 0.34
CES2 O00748 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
USP2 O75604 1/20 0.31
ATM Q13315 1/20 0.31
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 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
SCHEMBL7066435 0.82 CES1 (0.47) CES1TSHRHTTMEN1THRB
SCHEMBL25520454 0.82 CES1 (0.47) CES1TSHRHTTMEN1THRB
SCHEMBL6759981 0.80 CES1 (0.46) CES1TSHRHTTMEN1THRB
SCHEMBL7212323 0.78 TSHR (0.39) CES1TSHRHTTMEN1THRB
SCHEMBL28876463 0.78 CES1 (0.52) CES1TSHRHTTMEN1THRB
SCHEMBL5029913 0.77 TSHR (0.39) CES1TSHRHTTMEN1THRB
SCHEMBL15074938 0.76 CES1 (0.50) CES1TSHRHTTMEN1THRB
SCHEMBL4318571 0.76 TSHR (0.37) CES1TSHRCYP3A4ALDH1A1HPGD
SCHEMBL406283 0.76 CES1 (0.50) CES1TSHRHTTMEN1THRB
SCHEMBL4145527 0.76 TSHR (0.42) CES1TSHRHTTMEN1THRB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1274762-B1 POLYCARBONATE PREPARATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2005-05-11 EP claimed