SCHEMBL4399493

SCHEMBL4399493

C=CC(=O)OC(C)CC(N)(O)C(C)OC(=O)C=C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL3764879 0.82 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL28406611 0.82 TSHR (0.44) TSHRALDH1A1TP53CYP3A4MAPK1
Bromide SCHEMBL26661212 0.81 TSHR (0.40) TSHRALDH1A1TP53CYP3A4MAPK1
Hydrochloric Acid SCHEMBL2019274 0.81 TSHR (0.40) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL4655027 0.80 TSHR (0.42) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL23494088 0.78 TSHR (0.44) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL10787047 0.77 TSHR (0.42) TSHRALDH1A1TP53CYP3A4MAPK1
Sulfuric Acid SCHEMBL28894458 0.77 TSHR (0.37) TSHR
SCHEMBL8373742 0.77 TSHR (0.42) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL5833449 0.76 TSHR (0.39) TSHRALDH1A1TP53CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1162245-B1 COATED ARTICLE SDC TECHNOLOGIES ASIA LTD (JP) 2009-12-09 EP disclosed
EP-0922971-B1 PLASTIC LENSES AND PRIMER COMPOSITION USED FOR COATING THE SAME SDC TECHNOLOGIES ASIA LTD (JP) 2007-04-25 EP disclosed
US-20060079616-A1 Coating composition and coated plastic lenses NIPPON ARC CO., LTD. (JP) 2006-04-13 US disclosed
EP-1566418-A1 COATING COMPOSITION AND COATED PLASTIC LENSES NIPPON ARC CO., LTD. (JP) 2005-08-24 EP disclosed
US-20040105156-A1 Coated article KAYANOKI HISAYUKI (JP) 2004-06-03 US disclosed
US-6703131-B1 COATED PLASTIC LENS HAVING A TITANIUM OXIDE-CONTAINING RESIN COAT LAYER NIPPON ARC CO., LTD. (JP) 2004-03-09 US disclosed
EP-0791636-B1 PRIMER COMPOSITION NIPPON ARC CO LTD (JP) 2003-02-05 EP disclosed
US-6440568-B1 POLYURETHANE LAYER FORMED ON AT LEAST ONE SIDE OF THE SUBSTRATE AND A SILICON RESIN HARD COAT LAYER ON THE POLYURETHANE LAYER NIPPON ARC CO., LTD. (JP) 2002-08-27 US disclosed
EP-1162245-A1 COATED ARTICLE NIPPON ARC CO., LTD. (JP) 2001-12-12 EP disclosed
US-5963373-A EPOXY, POLYISOCYANATE NIPPON ARC CO., LTD. (JP) 1999-10-05 US disclosed
EP-0922971-A1 PLASTIC LENSES AND PRIMER COMPOSITION USED FOR COATING THE SAME NIPPON ARC CO., LTD. (JP) 1999-06-16 EP disclosed
US-5858077-A Coating composition capable of yielding a cured product having a high refractive index and coated articles obtained therefrom NIPPON ARC CO., LTD. (JP) 1999-01-12 US disclosed
EP-0791636-A1 PRIMER COMPOSITION NIPPON ARC CO., LTD. (JP) 1997-08-27 EP disclosed
US-5654090-A A HARD CURIED FILM ON PLASTIC LENS COMPRISING INORGANIC OXIDE PARTICLES AND ADDITION POLYMER BINDER ANCHORING BY A EPOXY SILICON COMPOUND, CURING AGENTS; DYEABLE, WEATHERPROOFING NIPPON ARC CO., LTD. (JP) 1997-08-05 US disclosed