SCHEMBL5569740

SCHEMBL5569740

COCCOCCOCCOCCOCCOCCOC(C)CCCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
TSHR P16473 2/20 0.36
FOLH1 Q04609 1/20 0.34
DDAH1 O94760 1/20 0.34
DGAT1 O75907 4/20 0.34
ENPEP Q07075 2/20 0.33
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
GABRA4 P48169 2/20 0.33
GABRE P78334 2/20 0.33
GABRA6 Q16445 2/20 0.33
GABRG1 Q8N1C3 2/20 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
SCHEMBL25206665 0.81 ALDH1A1 (0.39) ALDH1A1TSHRGSTK1EPHX2
Adipic Acid SCHEMBL4805967 0.80 ALDH1A1 (0.71) ALDH1A1TSHR
SCHEMBL27448986 0.80 ALDH1A1 (0.40) ALDH1A1TSHRGSTK1EPHX2
SCHEMBL7171241 0.79 AKR1B1 (0.45) ALDH1A1TSHR
SCHEMBL21876833 0.79 ALDH1A1 (0.35) ALDH1A1
SCHEMBL915377 0.78 ALDH1A1 (0.61) ALDH1A1TSHR
SCHEMBL21876923 0.78 ALDH1A1 (0.61) ALDH1A1TSHR
SCHEMBL17908913 0.78 ALDH1A1 (0.61) ALDH1A1TSHR
SCHEMBL2950323 0.78 ALDH1A1 (0.61) ALDH1A1TSHR
SCHEMBL29016026 0.78 ALDH1A1 (0.61) ALDH1A1TSHR

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
US-7166571-B2 Insulin polypeptide-oligomer conjugates, proinsulin polypeptide-oligomer conjugates and methods of synthesizing same BIOCON LIMITED (IN) 2007-01-23 US disclosed