SCHEMBL27901152

SCHEMBL27901152

CCCCCCCCCCCCCCCCCOC(=O)C(C)=CCCO

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
NAAA Q02083 1/20 0.46
HCAR2 Q8TDS4 2/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
FAAH O00519 2/20 0.43
EPHX1 P07099 1/20 0.43
ACHE P22303 6/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL27532618 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27958897 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27884049 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27884064 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27901216 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27589191 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27884162 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27901155 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27884059 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL1270267 1.00 TSHR (0.54) TSHRNAAAHCAR2RAD52NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105017083-A Methacrylate macromonomer containing fluorine structure but not containing bisphenol A structure, preparation method therefor and application thereof UNIV SOUTH CHINA TECH 2015-11-04 CN claimed
CN-105017083-A Methacrylate macromonomer containing fluorine structure but not containing bisphenol A structure, preparation method therefor and application thereof UNIV SOUTH CHINA TECH 2015-11-04 CN disclosed
CN-102816088-B Tertiary amine structure containing methacrylate macromonomer without bisphenol A structure, preparation method and application thereof UNIV SOUTH CHINA TECH 2014-05-07 CN disclosed
CN-102816088-A Tertiary amine structure containing methacrylate macromonomer without bisphenol A structure, preparation method and application thereof UNIV SOUTH CHINA TECH 2012-12-12 CN disclosed