SCHEMBL3687728

SCHEMBL3687728

CC(Cl)C(=O)OCCCCOC(=O)C(C)Cl

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TSHR P16473 3/20 0.36
CYP3A4 P08684 1/20 0.36
EPHX1 P07099 1/20 0.35
ATM Q13315 1/20 0.34
ACHE P22303 6/20 0.34

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
SCHEMBL3677498 0.97 NAAA (0.41) NAAAALDH1A1TSHRCYP3A4EPHX1
SCHEMBL3678099 0.97 NAAA (0.41) NAAAALDH1A1TSHRCYP3A4EPHX1
SCHEMBL3688262 0.97 NAAA (0.41) NAAAALDH1A1TSHRCYP3A4EPHX1
SCHEMBL3683996 0.95 ALDH1A1 (0.37) NAAAALDH1A1TSHRCYP3A4EPHX1
SCHEMBL7625792 0.91 NAAA (0.52) NAAAALDH1A1TSHRCYP3A4EPHX1
SCHEMBL3681746 0.89 LMNA (0.35) ALDH1A1TSHRACHE
SCHEMBL11783332 0.89 NAAA (0.55) NAAAALDH1A1TSHREPHX1ACHE
SCHEMBL21811593 0.89 NAAA (0.55) NAAAALDH1A1TSHREPHX1ACHE
SCHEMBL21381336 0.89 NAAA (0.55) NAAAALDH1A1TSHREPHX1ACHE
SCHEMBL21811448 0.89 NAAA (0.55) NAAAALDH1A1TSHREPHX1ACHE

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 7 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
CN-101490100-B Process for the preparation of crosslinked nitroxide polymers PIOTREK CO LTD 2012-08-22 CN disclosed
US-20100240858-A1 PROCESS FOR THE PREPARATION OF CROSSLINKED NITROXIDE POLYMERS PIOTREK CO., LTD. (JP) 2010-09-23 US disclosed
CN-101490100-A Process for the preparation of crosslinked nitroxide polymers PIOTREK CO LTD (JP) 2009-07-22 CN 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