SCHEMBL6658710

SCHEMBL6658710

C=C(C(=O)OCCCCCCCCC)C(=O)OCCCCCCCCC

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.74
RAD52 P43351 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
NAAA Q02083 1/20 0.57
EPHX1 P07099 1/20 0.53
HCAR2 Q8TDS4 1/20 0.48
ALDH1A1 P00352 2/20 0.47
FAAH O00519 1/20 0.47
LMNA P02545 1/20 0.47
ACHE P22303 6/20 0.47
DGKA P23743 1/20 0.47
HTR2C P28335 1/20 0.46

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
SCHEMBL31622801 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL31622788 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL31622800 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL31622786 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL31622794 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL31622795 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL5871868 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL31622783 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL6656457 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1
SCHEMBL31622790 1.00 TSHR (0.74) TSHRRAD52NPSR1NAAAEPHX1

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
EP-1123915-B1 Process for producing alpha, beta-unsaturated carboxylic acid esters and catalyst for use in such process NIPPON CATALYTIC CHEM IND (JP) 2004-07-28 EP disclosed
US-6541656-B2 Reacting an alpha, beta unsaturated carboxylic acid ester with a heterocyclic oxygen nitrogen, or sulfur compound NIPPON SHOKUBAI COMPANY, LTD. (JP) 2003-04-01 US disclosed
US-20010034300-A1 Reacting an alpha, beta unsaturated carboxylic acid ester with a heterocyclic oxygen nitrogen, or sulfur compound NIPPON SHOKUBAI COMPANY LTD. (JP) 2001-10-25 US disclosed
EP-1123915-A1 Process for producing alpha, beta-unsaturated carboxylic acid esters and catalyst for use in such process Nippon Shokubai Co., Ltd. (JP) 2001-08-16 EP disclosed
EP-0842112-A1 AQUEOUS PHASE PRODUCTION OF HYDROGEN PEROXIDE AND CATALYSTS FOR USE THEREIN Peroxco Inc. (CA) 1998-05-20 EP disclosed
WO-1997005058-A1 AQUEOUS PHASE PRODUCTION OF HYDROGEN PEROXIDE AND CATALYSTS FOR USE THEREIN PEROXCO INC. (CA) 1997-02-13 WO disclosed