SCHEMBL28301016

SCHEMBL28301016

CC(O)C(O)OP(=O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.35
LAP3 P28838 3/20 0.34
FDPS P14324 1/20 0.33
BLM P54132 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA4 P22748 1/20 0.32
CTSA P10619 1/20 0.32
ACHE P22303 1/20 0.32
PTPN1 P18031 1/20 0.32
CA2 P00918 1/20 0.30
PGK1 P00558 1/20 0.30
PGK2 P07205 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
SCHEMBL28302194 0.97 SMPD1 (0.34) SMPD1LAP3FDPSBLMTDP1
SCHEMBL31316283 0.83 LAP3 (0.36) SMPD1LAP3FDPSBLMTDP1
SCHEMBL11909257 0.78 CA4 (0.38) SMPD1LAP3FDPSBLMTDP1
SCHEMBL28622628 0.77 SMPD1 (0.38) SMPD1LAP3FDPSBLMTDP1
SCHEMBL8056927 0.77
SCHEMBL8060226 0.77 FDPS (0.37) SMPD1FDPSBLMTDP1PTPN1
SCHEMBL28287725 0.76 SMPD1 (0.34) SMPD1FDPSBLMTDP1CA4
SCHEMBL5144398 0.74
Phosphoric Acid SCHEMBL22576856 0.74 SMPD1 (0.41) SMPD1LAP3FDPSBLMTDP1
SCHEMBL29052980 0.74 SMPD1 (0.41) SMPD1LAP3FDPSBLMTDP1

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
CN-109847729-B Porous metal oxide-silica gel liquid chromatography packing and preparation method thereof 中国科学院大连化学物理研究所 2021-06-15 CN claimed
CN-109847729-A A kind of porous metal oxide-column chromatography on silica gel filler and preparation method thereof 中国科学院大连化学物理研究所 2019-06-07 CN claimed
CN-109847729-B Porous metal oxide-silica gel liquid chromatography packing and preparation method thereof 中国科学院大连化学物理研究所 2021-06-15 CN disclosed
CN-109847729-A A kind of porous metal oxide-column chromatography on silica gel filler and preparation method thereof 中国科学院大连化学物理研究所 2019-06-07 CN disclosed