SCHEMBL6741290

SCHEMBL6741290

C=C(C(=O)O)C(C1CCCC1)C1CCCC1.C=C(C)C(=O)OC.C=C(C)C(=O)OCC(C)C

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
ALDH1A1 P00352 2/20 0.39
RAB9A P51151 1/20 0.36
EPHX1 P07099 1/20 0.32
CACNA1F O60840 1/20 0.30
CACNA1D Q01668 1/20 0.30
CACNA1S Q13698 1/20 0.30
CACNA1C Q13936 1/20 0.30

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
SCHEMBL8978071 0.78 TSHR (0.88) TSHRALDH1A1CACNA1FCACNA1DCACNA1S
SCHEMBL27525471 0.77 TSHR (0.58) TSHRALDH1A1RAB9AEPHX1
Methacrylic Acid SCHEMBL1224497 0.77 EPHX1 (0.42) ALDH1A1EPHX1
SCHEMBL4871760 0.76 TSHR (0.58) TSHRALDH1A1RAB9AEPHX1
Methacrylic Acid SCHEMBL1472434 0.75 TSHR (0.88) TSHRALDH1A1RAB9ACACNA1FCACNA1D
SCHEMBL28007959 0.75 EPHX1 (0.43) TSHRALDH1A1EPHX1
SCHEMBL23493892 0.74 TSHR (0.56) TSHRALDH1A1EPHX1
SCHEMBL692105 0.74 TSHR (0.66) TSHRALDH1A1RAB9A
SCHEMBL24562 0.73 TSHR (1.00) TSHRALDH1A1RAB9A
SCHEMBL43523 0.73 EPHX1 (0.48) ALDH1A1RAB9AEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040091632-A1 Process for coating with radiation-curable resin composition and laminates MITSUBISHI CHEMICAL CORPORATION (JP) 2004-05-13 US disclosed
EP-1375614-A1 PROCESS FOR COATING WITH RADIATION-CURABLE RESIN COMPOSITION AND LAMINATES MITSUBISHI CHEMICAL CORPORATION (JP) 2004-01-02 EP disclosed