SCHEMBL916038

SCHEMBL916038

CCOP(=O)(OCC)c1cc(C)cc([N+](=O)[O-])c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.52
TSHR P16473 3/20 0.52
ACHE P22303 3/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
BCHE P06276 1/20 0.44
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP3A4 P08684 1/20 0.40
MAPK1 P28482 1/20 0.40
MAPT P10636 2/20 0.40
RAB9A P51151 1/20 0.40
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 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
SCHEMBL915834 0.85 TSHR (0.49) NPSR1TSHRACHECA1CA2
SCHEMBL914637 0.82 NPSR1 (0.56) NPSR1TSHRACHECA1CA2
SCHEMBL2534198 0.81 TSHR (0.40) NPSR1TSHRACHECA1CA2
SCHEMBL917312 0.78 NPSR1 (0.78) NPSR1TSHRACHECA1CA2
SCHEMBL31688370 0.78 NPSR1 (0.78) NPSR1TSHRACHECA1CA2
SCHEMBL914889 0.77 ACHE (0.61) NPSR1TSHRACHECA1CA2
SCHEMBL3403347 0.75 TSHR (0.61) TSHRACHEALDH1A1HSD17B10CYP3A4
SCHEMBL915754 0.75 TSHR (0.61) TSHRACHECA1ALDH1A1HSD17B10
SCHEMBL3403352 0.73 TSHR (0.59) TSHRACHECA1ALDH1A1HSD17B10
SCHEMBL12229708 0.73 MEN1 (0.35) NPSR1TSHRACHEALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868126-B2 Process for producing polyester, polyester produced using said process, and polyester molded product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2011-01-11 US disclosed
EP-1842868-B1 PROCESS FOR PRODUCING POLYESTER, POLYESTER PRODUCED USING SAID PROCESS, AND POLYESTER MOLDED PRODUCT TOYO BOSEKI (JP) 2010-11-10 EP disclosed
US-20090082529-A1 Polyester, Process for Producing Polyester, and Polyester Molded Article TOYO BOSEKI KABUSHIKI KAISHA (JP) 2009-03-26 US disclosed
US-20080249280-A1 Process for Producing Polyester, Polyester Produced Using Said Process, and Polyester Molded Product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-10-09 US disclosed
EP-1932867-A1 POLYESTER, PROCESS FOR PRODUCTION OF POLYESTER, AND POLYESTER MOLDED ARTICLE Toyo Boseki Kabushiki Kasisha (JP) 2008-06-18 EP disclosed
EP-1842868-A1 PROCESS FOR PRODUCING POLYESTER, POLYESTER PRODUCED USING SAID PROCESS, AND POLYESTER MOLDED PRODUCT Toyo Boseki Kabushiki Kasisha (JP) 2007-10-10 EP disclosed