SCHEMBL9314309

SCHEMBL9314309

CO[C@H]1O[C@H](CO)[C@@H](O)C[C@@H]1NC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ CD69 Q07108 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MGAM O43451 2/20 0.39
▸ SI P14410 2/20 0.39
▸ OGA O60502 1/20 0.38
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ PYGB P11216 1/20 0.37
▸ LGALS3 P17931 2/20 0.36
▸ LGALS1 P09382 1/20 0.36
▸ LGALS7; LGALS7B P47929 1/20 0.36

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
SCHEMBL9314303 1.00 LGALS8 (0.42) LGALS8ALDH1A1THRBCD69MAPK1
SCHEMBL9314298 1.00 LGALS8 (0.42) LGALS8ALDH1A1THRBCD69MAPK1
SCHEMBL7148353 0.86 CA1 (0.33) LGALS8ALDH1A1THRBCD69MAPK1
SCHEMBL9314131 0.81 OGA (0.41) ALDH1A1THRBCD69MAPK1OGA
SCHEMBL21686200 0.81 MGAM (0.42) LGALS8MGAMSIOGACA2
SCHEMBL9314127 0.81 OGA (0.41) ALDH1A1THRBCD69MAPK1OGA
SCHEMBL14669268 0.81 OGA (0.41) ALDH1A1THRBCD69MAPK1OGA
SCHEMBL20812843 0.81 OGA (0.41) ALDH1A1THRBCD69MAPK1OGA
SCHEMBL9314136 0.81 OGA (0.41) ALDH1A1THRBCD69MAPK1OGA
SCHEMBL7893025 0.81 MAPK1 (0.38) LGALS8ALDH1A1THRBCD69MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5332756-A Angiogenesis inhibitor, antitumor FARMITALIA CARLO ERBA S.R.L. (IT) 1994-07-26 — — US disclosed
EP-0527042-A2 3-deoxy-mannosamine derivatives and process for their preparation PHARMACIA S.p.A. (IT) 1993-02-10 — — EP disclosed
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