SCHEMBL12830828

SCHEMBL12830828

OCCC1(O)O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PYGB P11216 8/20 0.35
▸ PYGL P06737 3/20 0.35
▸ PYGM P11217 2/20 0.35
▸ LMNA P02545 1/20 0.31
▸ GBA1 P04062 1/20 0.31
▸ CDK1 P06493 1/20 0.31
▸ CCNB1 P14635 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
SCHEMBL21914139 1.00 MEN1 (0.38) MEN1KMT2APYGBPYGLPYGM
SCHEMBL13276647 0.94 PYGB (0.41) MEN1KMT2APYGBPYGLPYGM
Ethylene Glycol SCHEMBL3034570 0.83 MEN1 (0.49) MEN1KMT2APYGBPYGLPYGM
SCHEMBL2853265 0.83 MEN1 (0.51) MEN1KMT2APYGBPYGLPYGM
SCHEMBL9006 0.83 MEN1 (0.51) MEN1KMT2APYGBPYGLPYGM
SCHEMBL10013929 0.83 MEN1 (0.51) MEN1KMT2APYGBPYGLPYGM
SCHEMBL4969252 0.83 MEN1 (0.51) MEN1KMT2APYGBPYGLPYGM
SCHEMBL2857459 0.83 MEN1 (0.51) MEN1KMT2APYGBPYGLPYGM
SCHEMBL6376667 0.83 MEN1 (0.51) MEN1KMT2APYGBPYGLPYGM
SCHEMBL12689155 0.83 MEN1 (0.51) MEN1KMT2APYGBPYGLPYGM

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
WO-2011027248-A1 ORAL LIQUID FORMULATION COMPRISING SALBUTAMOL AND GUAIFENESIN VANANGAMUDI SULUR SUBRAMANIAM (IN) 2011-03-10 — — WO disclosed
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