SCHEMBL1403670

SCHEMBL1403670

O=C(O)OC1C(O)C(O)C(O)C(O)C1O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITPR3 Q14573 5/20 0.38
ITPR2 Q14571 2/20 0.38
ITPR1 Q14643 2/20 0.38
LMNA P02545 1/20 0.31
APP P05067 1/20 0.31
INPP5A Q14642 1/20 0.31

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
SCHEMBL2812221 0.97 ITPR3 (0.36) ITPR3ITPR2ITPR1
SCHEMBL1554143 0.79 CA1 (0.31)
SCHEMBL8644323 0.79 CA1 (0.31)
SCHEMBL933668 0.79 CA1 (0.31)
SCHEMBL8932121 0.79 CA1 (0.31)
SCHEMBL2936710 0.79 CA1 (0.31)
Water SCHEMBL16551673 0.76
SCHEMBL12858898 0.73 ITPR3 (0.36) ITPR3ITPR2ITPR1
SCHEMBL9551236 0.73 ITPR3 (0.36) ITPR3ITPR2ITPR1
SCHEMBL9551238 0.73 ITPR3 (0.36) ITPR3ITPR2ITPR1

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-20110212541-A1 COMPOSITIONS AND METHODS TO PROTECT CELLS BY BLOCKING ENTRY OF PATHOGEN PROTEINS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2011-09-01 US claimed
WO-2011060144-A2 COMPOSITIONS AND METHODS TO PROTECT CELLS BY BLOCKING ENTRY OF PATHOGEN PROTEINS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2011-05-19 WO claimed
EP-2291188-A2 COMPOSITIONS AND METHODS TO PROTECT CELLS BY BLOCKING ENTRY OF PATHOGEN PROTEINS Virginia Tech Intellectual Properties, Inc. (US) 2011-03-09 EP claimed
US-20100093601-A1 COMPOSITIONS AND METHODS TO PROTECT CELLS BY BLOCKING ENTRY OF PATHOGEN PROTEINS VIRGINIA POLYTECHNIC INSTITUTE AND STATE UNIVERSITY 2010-04-15 US claimed
WO-2009143133-A2 COMPOSITIONS AND METHODS TO PROTECT CELLS BY BLOCKING ENTRY OF PATHOGEN PROTEINS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2009-11-26 WO claimed