SCHEMBL3684667

SCHEMBL3684667

O=C(CCl)OCCCCCCCCCCCCOC(=O)CCl

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.50
TSHR P16473 3/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FAAH O00519 1/20 0.41
ACHE P22303 6/20 0.40
HTR2C P28335 1/20 0.39
DGKA P23743 1/20 0.39
EPHX1 P07099 1/20 0.37
HTT P42858 1/20 0.36

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
SCHEMBL21811615 1.00 NAAA (0.50) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL1036267 1.00 NAAA (0.50) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL3681811 1.00 NAAA (0.50) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL2577539 0.97 NAAA (0.46) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL21381333 0.93 NAAA (0.45) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL1038120 0.92 NAAA (0.41) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL24234905 0.91 ACHE (0.47) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL16663663 0.91 ACHE (0.47) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL8095255 0.90 NAAA (0.41) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL2434790 0.89 NAAA (0.69) NAAATSHRRAD52NPSR1FAAH

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2013240-B1 PROCESS FOR THE PREPARATION OF CROSSLINKED NITROXIDE POLYMERS PIOTREK CO LTD (JP) 2017-05-31 EP disclosed
US-8492511-B2 Process for the preparation of crosslinked nitroxide polymers PIOTREK CO., LTD. (JP) 2013-07-23 US disclosed
US-20100240858-A1 PROCESS FOR THE PREPARATION OF CROSSLINKED NITROXIDE POLYMERS PIOTREK CO., LTD. (JP) 2010-09-23 US disclosed
EP-2013240-A1 PROCESS FOR THE PREPARATION OF CROSSLINKED NITROXIDE POLYMERS PIOTREK CO., LTD. (JP) 2009-01-14 EP disclosed
WO-2007115939-A1 PROCESS FOR THE PREPARATION OF CROSSLINKED NITROXIDE POLYMERS PIOTREK CO., LTD. (JP) 2007-10-18 WO disclosed