SCHEMBL11234772

SCHEMBL11234772

CCCCC(C)OC(=O)C1CCCCC1(C)C(=O)OC(C)CCCC

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.36
CTSL P07711 4/20 0.36
CTSB P07858 4/20 0.36
EPHX2 P34913 1/20 0.34
FAAH O00519 5/20 0.33
CTSH P09668 2/20 0.32
NAAA Q02083 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
MMP1 P03956 1/20 0.32
MMP7 P09237 1/20 0.32
MMP12 P39900 1/20 0.32
ECE1 P42892 1/20 0.32
MMP13 P45452 1/20 0.32
CTSV O60911 1/20 0.30
CTSS P25774 1/20 0.30

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
SCHEMBL11229536 0.92 CTSL (0.33) CTSKCTSLCTSBCTSH
SCHEMBL11229001 0.73 CYP3A4 (0.37) EPHX2
SCHEMBL11232319 0.72 EPHX2 (0.33) CTSKCTSLCTSBEPHX2FAAH
SCHEMBL11229711 0.71 NAAA (0.38) EPHX2NAAA
SCHEMBL11225142 0.71 NAAA (0.38) EPHX2NAAA
SCHEMBL11225149 0.71 NAAA (0.38) EPHX2NAAA
SCHEMBL9283997 0.70 FAAH (0.46) CTSKCTSLCTSBFAAHNAAA
SCHEMBL11230973 0.69 CYP3A4 (0.34)
SCHEMBL9561709 0.69 PRCP (0.46) CTSKCTSLCTSBEPHX2FAAH
SCHEMBL21950906 0.69 F10 (0.41)

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-4314946-A Process for the continuous separation of maleic anhydride from process gases FTALITAL PRODOTTI CHIMICI SPECIALI S.P.A. (IT) 1982-02-09 US disclosed