SCHEMBL8993994

SCHEMBL8993994

O=C1OC[C@](O)(Cc2ccccc2)[C@]1(O)Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.39
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
NPSR1 Q6W5P4 2/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP2C19 P33261 1/20 0.33
FKBP1A P62942 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
NAAA Q02083 1/20 0.33
HSD11B1 P28845 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33

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
SCHEMBL576999 0.73 LMNA (0.47) TOP2AMAOAMAOBNPSR1LMNA
SCHEMBL3530370 0.71 TOP2A (0.42) TOP2AMAOAMAOBNPSR1LMNA
SCHEMBL11696413 0.70 CNR2 (0.43) TOP2AMAOAMAOBNPSR1LMNA
SCHEMBL6380088 0.67 MAOA (0.42) MAOAMAOBNPSR1LMNAHTT
SCHEMBL576279 0.67 L3MBTL1 (0.45) MAOAMAOBNPSR1LMNAHTT
Hydrochloric Acid SCHEMBL28211399 0.66 L3MBTL1 (0.44) MAOAMAOBNPSR1LMNAHTT
SCHEMBL8315407 0.66 MAOA (0.37) TOP2AMAOAMAOBNPSR1LMNA
SCHEMBL11498993 0.65 MAOA (0.43) MAOAMAOBLMNAALDH1A1TSHR
SCHEMBL10442397 0.64 MAOA (0.48) MAOAMAOBNPSR1LMNAHTT
SCHEMBL7353378 0.64 ELANE (0.40) MAOAMAOBNPSR1L3MBTL1MEN1

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
US-5484925-A Synthesis of (-)-swainsonine and intermediate compounds employed in such synthesis GLYCODESIGN HOLDINGS LTD. (CA) 1996-01-16 US disclosed
US-5288875-A Synthesis of (-)-swainsonine and intermediate compounds employed in such synthesis GLYCODESIGN HOLDINGS LTD. (CA) 1994-02-22 US disclosed
US-5187279-A Synthesis of (-) swainsonine and intermediate compounds employed in such synthesis GLYCODESIGN HOLDINGS LTD. (CA) 1993-02-16 US disclosed
WO-1990006311-A1 SYNTHESIS OF (-)-SWAINSONINE AND INTERMEDIATE COMPOUNDS EMPLOYED IN SUCH SYNTHESIS VANDERBILT UNIVERSITY (US) 1990-06-14 WO disclosed