SCHEMBL2357536

SCHEMBL2357536

C=C(CC(=O)OCCCCCCCCCCCC)C(=O)O[SiH2]CCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.48
TSHR P16473 2/20 0.47
NAAA Q02083 1/20 0.47
HTR2C P28335 1/20 0.43
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
EPHX1 P07099 1/20 0.41
DGKA P23743 1/20 0.40
ACHE P22303 6/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37

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
SCHEMBL2353867 0.87 POLB (0.41) FAAHTSHRNAAAEPHX1DGKA
SCHEMBL2351126 0.87 POLB (0.41) FAAHTSHRNAAAEPHX1DGKA
SCHEMBL22615726 0.85 NAAA (0.56) FAAHTSHRNAAAHTR2CRAD52
SCHEMBL27879430 0.85 NAAA (0.56) FAAHTSHRNAAAHTR2CRAD52
SCHEMBL28835266 0.83 NAAA (0.55) FAAHTSHRNAAAHTR2CRAD52
SCHEMBL3138822 0.83 TSHR (0.62) FAAHTSHRNAAAHTR2CRAD52
SCHEMBL892067 0.83 TSHR (0.62) FAAHTSHRNAAAHTR2CRAD52
SCHEMBL3128485 0.83 TSHR (0.62) FAAHTSHRNAAAHTR2CRAD52
SCHEMBL9799832 0.83 TSHR (0.62) FAAHTSHRNAAAHTR2CRAD52
SCHEMBL1561906 0.83 TSHR (0.62) FAAHTSHRNAAAHTR2CRAD52

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
WO-2011092143-A1 ANTIFOULING COMPOSITION JOTUN A/S (NO) 2011-08-04 WO disclosed