SCHEMBL28222136

SCHEMBL28222136

CCCCCCCCCCCCCCCCCCOC(=O)C(C(C)=O)(C(C)C)C(C)C.[AlH3]

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
NAAA Q02083 1/20 0.46
HCAR2 Q8TDS4 2/20 0.44
EPHX1 P07099 1/20 0.43
ALDH1A1 P00352 2/20 0.41
CES2 O00748 1/20 0.41
RAD52 P43351 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
FAAH O00519 1/20 0.39
LMNA P02545 1/20 0.39
ACHE P22303 4/20 0.39

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
SCHEMBL28221456 1.00 TSHR (0.46) TSHRNAAAHCAR2EPHX1ALDH1A1
SCHEMBL28222076 0.91 FAAH (0.47) HCAR2FAAH
SCHEMBL231255 0.82 ALDH1A1 (0.50) TSHRNAAAHCAR2EPHX1ALDH1A1
SCHEMBL18722879 0.77 NAAA (0.50) TSHRNAAAHCAR2EPHX1ALDH1A1
SCHEMBL27836874 0.77 ALDH1A1 (0.45) TSHRNAAAHCAR2EPHX1ALDH1A1
SCHEMBL12504581 0.75 NAAA (0.47) TSHRNAAAHCAR2EPHX1ALDH1A1
SCHEMBL12504432 0.75 NAAA (0.47) TSHRNAAAHCAR2EPHX1ALDH1A1
SCHEMBL21357721 0.75 NAAA (0.47) TSHRNAAAHCAR2EPHX1ALDH1A1
SCHEMBL12504202 0.75 NAAA (0.47) TSHRNAAAHCAR2EPHX1ALDH1A1
SCHEMBL232410 0.74 HCAR2 (0.38) TSHRHCAR2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108138005-A The manufacturing method of bonding sheet and bonding sheet 琳得科株式会社 2018-06-08 CN disclosed
CN-108138010-A The manufacturing method of bonding sheet and bonding sheet 琳得科株式会社 2018-06-08 CN disclosed