SCHEMBL29626989

SCHEMBL29626989

CCCCCCOC(=O)C(N)CCCC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 5/20 0.58
NAAA Q02083 1/20 0.52
DPP7 Q9UHL4 1/20 0.49
EPHX1 P07099 1/20 0.48
TSHR P16473 3/20 0.47
HTR2C P28335 1/20 0.46
SLC15A1 P46059 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 1/20 0.44
FAAH O00519 1/20 0.43

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
SCHEMBL8666006 1.00 NOD1 (0.58) NOD1NAAADPP7EPHX1TSHR
SCHEMBL31029306 1.00 NOD1 (0.58) NOD1NAAADPP7EPHX1TSHR
SCHEMBL25856290 0.96 NOD1 (0.62) NOD1NAAADPP7EPHX1TSHR
SCHEMBL8601166 0.92 NOD1 (0.55) NOD1NAAADPP7EPHX1TSHR
SCHEMBL27586212 0.92 NOD1 (0.55) NOD1NAAADPP7EPHX1TSHR
SCHEMBL1097461 0.92 NOD1 (0.50) NOD1NAAADPP7TSHRSLC15A1
SCHEMBL4957809 0.92 NOD1 (0.50) NOD1NAAADPP7TSHRSLC15A1
SCHEMBL19547623 0.91 NOD1 (0.54) NOD1NAAADPP7EPHX1TSHR
SCHEMBL1516507 0.91 NOD1 (0.54) NOD1NAAADPP7EPHX1TSHR
SCHEMBL19547626 0.91 NOD1 (0.54) NOD1NAAADPP7EPHX1TSHR

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
CN-114501996-A Chemical, method for producing chemical, and method for purifying water 株式会社ACENET 2022-05-13 CN disclosed