SCHEMBL12545145

SCHEMBL12545145

CC1(C)CC(OCCOCCO)CC(C)(C)[NH+]1[O-]

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TSHR P16473 2/20 0.33
MAPK1 P28482 1/20 0.33
THRB P10828 1/20 0.32
HTT P42858 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL1138466 0.78
SCHEMBL18878972 0.76 MEN1 (0.39) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL3610461 0.74 EPHX2 (0.31)
SCHEMBL4562188 0.73 MEN1 (0.37) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL11347726 0.69 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL29929604 0.67 MEN1 (0.41) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL8018177 0.66 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL8019810 0.66 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL20129165 0.66 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB
Di(Hydroxyethyl)Ether SCHEMBL28803470 0.65 TSHR (0.54) MEN1KMT2ATSHRMAPK1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912287-B2 Method for producing polymer using monomer having piperidine skeleton, and molded body MITSUBISHI RAYON CO., LTD. (JP) 2014-12-16 US disclosed
EP-2508542-A1 METHOD OF PRODUCING A POLYMER USING MONOMERS HAVING A PIPERIDINE SKELETON, AND MOLDED BODY Mitsubishi Rayon Co., Ltd. (JP) 2012-10-10 EP disclosed
US-20120245318-A1 METHOD FOR PRODUCING POLYMER USING MONOMER HAVING PIPERIDINE SKELETON, AND MOLDED BODY MITSUBISHI RAYON CO., LTD. (JP) 2012-09-27 US disclosed