SCHEMBL4444585

SCHEMBL4444585

CC[P+](CC)(CC)CC.O=P(=O)[O-]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL2862407 0.76 TSHR (0.33)
SCHEMBL29563566 0.76
SCHEMBL11184354 0.72 TSHR (0.31)
SCHEMBL4447506 0.71
Formic Acid SCHEMBL1036700 0.71 ALDH1A1 (0.35)
Phosphoric Acid SCHEMBL8972819 0.71 TRPM8 (0.36)
Bicarbonate SCHEMBL7573097 0.71 CYP3A4 (0.41)
SCHEMBL8200658 0.71 ALDH1A1 (0.48)
SCHEMBL191974 0.71
Sulfuric Acid SCHEMBL7639276 0.71 TP53 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8575302-B2 Polylactide composition TEIJIN LIMITED (JP) 2013-11-05 US claimed
EP-1956045-B1 POLYLACTIC ACID COMPOSITION TEIJIN LTD (JP) 2013-11-20 EP disclosed
US-8575302-B2 Polylactide composition TEIJIN LIMITED (JP) 2013-11-05 US disclosed
US-20090234094-A1 POLYLACTIDE COMPOSITION TEIJIN LIMITED (JP) 2009-09-17 US disclosed
EP-1956045-A1 POLYLACTIC ACID COMPOSITION TEIJIN LIMITED (JP) 2008-08-13 EP disclosed