SCHEMBL11284071

SCHEMBL11284071

C=CC(=O)OC(CCC)N(CCCCCCCC)CCCCCCCC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
HPGD P15428 1/20 0.41
ZDHHC20 Q5W0Z9 3/20 0.39
ZDHHC2 Q9UIJ5 2/20 0.39
THRB P10828 2/20 0.36
THRA P10827 1/20 0.36
EPHX2 P34913 2/20 0.35
FAAH O00519 1/20 0.34
NOD1 Q9Y239 2/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
FFAR4 Q5NUL3 1/20 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
SCHEMBL2830764 0.94 TSHR (0.43) TSHRHPGDZDHHC20ZDHHC2THRB
SCHEMBL14956997 0.92 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2THRB
SCHEMBL1235391 0.89 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2THRB
SCHEMBL8415194 0.89 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2THRB
SCHEMBL11279407 0.89 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2THRB
SCHEMBL8827503 0.87 TSHR (0.38) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL11281825 0.86 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2THRB
SCHEMBL499683 0.83 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2THRB
SCHEMBL500591 0.83 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2THRB
SCHEMBL499596 0.83 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2THRB

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-0047009-A1 Hydrophilic interpolymers of acrylic acid and an olefin or a styrene The B.F. GOODRICH Company (US) 1982-03-10 EP disclosed