SCHEMBL915834

SCHEMBL915834

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.49
NPC1 O15118 1/20 0.43
ACHE P22303 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
BCHE P06276 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
RAB9A P51151 1/20 0.41
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
AKR1C3 P42330 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HTT P42858 2/20 0.36
POLB P06746 1/20 0.36
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.34
GPR35 Q9HC97 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
SCHEMBL916038 0.85 NPSR1 (0.52) TSHRNPC1ACHECA1CA2
SCHEMBL915429 0.83 NPSR1 (0.45) TSHRNPC1ACHECA1CA2
SCHEMBL31688371 0.82 NPSR1 (0.60) TSHRACHECA1CA2BCHE
SCHEMBL915432 0.82 NPSR1 (0.60) TSHRACHECA1CA2BCHE
SCHEMBL915754 0.79 TSHR (0.61) TSHRACHECA1ALDH1A1CYP3A4
SCHEMBL916414 0.78 CA1 (0.58) TSHRACHECA1CA2BCHE
SCHEMBL3403352 0.78 TSHR (0.59) TSHRACHECA1ALDH1A1CYP3A4
SCHEMBL12229778 0.75 PGK1 (0.42) ALDH1A1MAPTCYP3A4HTTPOLB
SCHEMBL12229773 0.75 ALDH1A1 (0.35) TSHRNPSR1ALDH1A1MAPTMAPK1
SCHEMBL12229768 0.75 MEN1 (0.37) NPC1ALDH1A1MAPTPOLBGAA

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