SCHEMBL4399491

SCHEMBL4399491

C=CC(=O)OCCC(O)(CN)CCOC(=O)C=C

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.50
ALDH1A1 P00352 4/20 0.50
TP53 P04637 3/20 0.50
HIF1A Q16665 3/20 0.50
CYP3A4 P08684 2/20 0.50
HSD17B10 Q99714 1/20 0.50
HPGD P15428 1/20 0.46
THRB P10828 2/20 0.42
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL29871291 0.79 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL25121369 0.79 TSHR (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9635084 0.78 TSHR (0.56) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4832680 0.78 TSHR (0.56) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL16939126 0.77 TSHR (0.60) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL18051631 0.76 TSHR (0.54) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4653958 0.76 TSHR (0.54) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL117942 0.74
SCHEMBL1462384 0.74 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL8965858 0.74 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4

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