SCHEMBL28061817

SCHEMBL28061817

CCCCCCCCCCCCCCCCCCOC(=O)OCC(Cl)(Cl)Cl

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.50
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
EPHX1 P07099 1/20 0.47
TSHR P16473 3/20 0.46
HCAR2 Q8TDS4 1/20 0.43
ALDH1A1 P00352 2/20 0.42
FAAH O00519 1/20 0.42
LMNA P02545 1/20 0.42
ACHE P22303 6/20 0.42
DGKA P23743 1/20 0.41
HTR2C P28335 1/20 0.41

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
SCHEMBL877905 0.98 NAAA (0.47) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1839498 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1835881 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1841329 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1838958 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1837444 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1834574 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1835519 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1839030 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL119774 0.84 NAAA (0.67) NAAARAD52NPSR1EPHX1TSHR

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-105461183-A Treatment method for excess activated sludge in AOX pollution YANGTZE DELTA REGION INST OF TSINGHUA UNIV ZHEJIANG 2016-04-06 CN disclosed