SCHEMBL1984891

SCHEMBL1984891

CCCC=C(C#N)C(=O)OC(=O)CO

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.36
ALDH1A1 P00352 1/20 0.30
TSHR P16473 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
SCHEMBL540715 0.90 CYP2C9 (0.34) CYP2C9
SCHEMBL1988663 0.89 EP300 (0.38) CYP2C9ALDH1A1
SCHEMBL1987673 0.88 EP300 (0.40) CYP2C9
SCHEMBL1987588 0.88 EP300 (0.40) CYP2C9
SCHEMBL540780 0.86 CYP2C9 (0.38) CYP2C9ALDH1A1TSHR
SCHEMBL27679283 0.79 CYP2C9 (0.40) CYP2C9ALDH1A1TSHR
SCHEMBL17859724 0.79 CYP2C9 (0.40) CYP2C9ALDH1A1TSHR
SCHEMBL29113121 0.79 CYP2C9 (0.33) CYP2C9
SCHEMBL1985139 0.79 CYP2C9 (0.32) CYP2C9
SCHEMBL27741569 0.79 CYP2C9 (0.45) CYP2C9ALDH1A1TSHR

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-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
US-20110152924-A1 OXIDIZED REGENERATED CELLULOSE ADHESIVE TAPE ADVANCED TECHNOLOGIES AND REGENERATIVE MEDICINE, LLC 2011-06-23 US 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
US-20110152924-A1 OXIDIZED REGENERATED CELLULOSE ADHESIVE TAPE ADVANCED TECHNOLOGIES AND REGENERATIVE MEDICINE, LLC 2011-06-23 US disclosed