SCHEMBL5485138

SCHEMBL5485138

O=C(CO)COP(=O)(O)OP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MVD P53602 6/20 0.47
BTN3A1 O00481 7/20 0.47
FDPS P14324 1/20 0.38
BLM P54132 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL10876378 0.96 MVD (0.45) MVDBTN3A1FDPSBLMTDP1
SCHEMBL29018985 0.86 TPI1 (0.34) MVDBTN3A1
SCHEMBL20798014 0.83 TPI1 (0.43) MVDBTN3A1
SCHEMBL43277 0.81 TPI1 (0.50) FDPSBLMTDP1
Water SCHEMBL28701484 0.79 TPI1 (0.48) BTN3A1
Hydrogen Peroxide SCHEMBL28079410 0.79 TPI1 (0.48) MVD
SCHEMBL28769882 0.79 TPI1 (0.48)
SCHEMBL29156118 0.79 TPI1 (0.48)
SCHEMBL28740334 0.79 LPAR3 (0.46) MVDBTN3A1
SCHEMBL15150489 0.78 PLA2G2A (0.34) MVDBTN3A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070298484-A1 Method and Device for Thermal Conditioning of a Cell INSILICO BIOTECHNOLOGY GMBH (DE) 2007-12-27 US disclosed