SCHEMBL11198736

SCHEMBL11198736

CCCCCOC(=O)CNCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.55
FAAH O00519 2/20 0.50
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
EPHX1 P07099 1/20 0.47
EPHX2 P34913 2/20 0.46
DGKA P23743 1/20 0.46
HTR2C P28335 1/20 0.45
HCAR2 Q8TDS4 2/20 0.44
AKR1B1 P15121 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
PPARG P37231 4/20 0.42
PPARD Q03181 4/20 0.42
PPARA Q07869 4/20 0.42
TSHR P16473 3/20 0.42
GPR84 Q9NQS5 3/20 0.42
HDAC11 Q96DB2 3/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 2/20 0.42

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
SCHEMBL5497225 0.98 NAAA (0.58) NAAAFAAHRAD52NPSR1EPHX1
SCHEMBL11184933 0.98 NAAA (0.58) NAAAFAAHRAD52NPSR1EPHX1
SCHEMBL10698634 0.94 NAAA (0.47) NAAAFAAHRAD52NPSR1EPHX1
SCHEMBL11184931 0.90 NAAA (0.67) NAAAFAAHRAD52NPSR1EPHX1
SCHEMBL5497221 0.90 NAAA (0.67) NAAAFAAHRAD52NPSR1EPHX1
SCHEMBL5067226 0.90 NAAA (0.67) NAAAFAAHRAD52NPSR1EPHX1
SCHEMBL31011371 0.90 NAAA (0.67) NAAAFAAHRAD52NPSR1EPHX1
SCHEMBL17970768 0.87 CA1 (0.46) NAAAFAAHEPHX2HCAR2CA1
SCHEMBL11280682 0.86 CA1 (0.45) NAAADGKAHCAR2CA1CA2
SCHEMBL8390838 0.86 ALDH1A1 (0.54) NAAAFAAHRAD52NPSR1EPHX1

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-4421693-A INSECTICIDES, MITICIDES OR NEMATOCIDES OTSUKA CHEMICAL CO., LTD. (JP) 1983-12-20 US disclosed