SCHEMBL18868622

SCHEMBL18868622

C[C@@H]1O[C@H](CO)C(OP)[C@@H]1O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AMY1A P0DUB6 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ PYGB P11216 1/20 0.32
▸ LGALS1 P09382 2/20 0.31
▸ LGALS3 P17931 2/20 0.31
▸ LGALS8 O00214 2/20 0.31
▸ LGALS9 O00182 1/20 0.31
▸ SLC2A1 P11166 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL13039997 0.84 — —
SCHEMBL9912325 0.82 AMY2A (0.39) AMY1AALDH1A1TSHRLMNATDP1
SCHEMBL11892843 0.82 AMY2A (0.39) AMY1AALDH1A1TSHRLMNATDP1
SCHEMBL23188294 0.80 LGALS8 (0.31) LGALS8
SCHEMBL13205044 0.80 AMY1A (0.38) AMY1AALDH1A1TSHRLMNATDP1
SCHEMBL22423226 0.78 LGALS8 (0.45) AMY1APYGBLGALS1LGALS3LGALS8
SCHEMBL9914030 0.78 LGALS8 (0.45) AMY1APYGBLGALS1LGALS3LGALS8
SCHEMBL21083400 0.78 LGALS8 (0.45) AMY1APYGBLGALS1LGALS3LGALS8
SCHEMBL21077738 0.78 LGALS8 (0.45) AMY1APYGBLGALS1LGALS3LGALS8
SCHEMBL23603150 0.78 LGALS8 (0.45) AMY1APYGBLGALS1LGALS3LGALS8

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-20170137815-A1 NOVEL SINGLE CHEMICAL ENTITIES AND METHODS FOR DELIVERY OF OLIGONUCLEOTIDES SIRNA THERAPEUTICS INC (US) 2017-05-18 — — US disclosed
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