SCHEMBL2297614

SCHEMBL2297614

C=C(C#N)C(=O)OC(CC)CC(=O)OCC.C=C(C#N)C(=O)OC(CCC)CC(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.50
CYP2C9 P11712 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
SCHEMBL540819 0.96 ALDH1A1 (0.54) ALDH1A1TSHRCYP2C9
SCHEMBL1990863 0.93 ALDH1A1 (0.57) ALDH1A1TSHRCYP2C9
SCHEMBL1990973 0.88 ALDH1A1 (0.51) ALDH1A1TSHRCYP2C9
SCHEMBL1987524 0.87 TSHR (0.50) ALDH1A1TSHRCYP2C9
SCHEMBL15519639 0.84 ALDH1A1 (0.50) ALDH1A1TSHR
SCHEMBL1984781 0.82 ALDH1A1 (0.54) ALDH1A1TSHRCYP2C9
SCHEMBL15519449 0.81 ALDH1A1 (0.53) ALDH1A1TSHR
SCHEMBL12335165 0.79 MGAM (0.39) ALDH1A1TSHR
SCHEMBL5889388 0.78 ALDH1A1 (0.57) ALDH1A1TSHRCYP2C9
SCHEMBL540851 0.77 ALDH1A1 (0.59) ALDH1A1TSHRCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2515954-A1 OXIDIZED REGENERATED CELLULOSE ADHESIVE TAPE Advanced Technologies and Regenerative Medicine, LLC (US) 2012-10-31 EP claimed
WO-2011087722-A1 OXIDIZED REGENERATED CELLULOSE ADHESIVE TAPE ADVANCED TECHNOLOGIES AND REGENERATIVE MEDICINE, LLC (US) 2011-07-21 WO claimed
EP-2515954-A1 OXIDIZED REGENERATED CELLULOSE ADHESIVE TAPE Advanced Technologies and Regenerative Medicine, LLC (US) 2012-10-31 EP disclosed
WO-2011087722-A1 OXIDIZED REGENERATED CELLULOSE ADHESIVE TAPE ADVANCED TECHNOLOGIES AND REGENERATIVE MEDICINE, LLC (US) 2011-07-21 WO disclosed