SCHEMBL8353589

SCHEMBL8353589

CCOC(=O)C1(C(=O)O)CC1CO

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.36
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
GAA P10253 2/20 0.34
POLB P06746 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
KMT2A Q03164 1/20 0.33
F10 P00742 1/20 0.33
ALDH1A1 P00352 2/20 0.32
OPRD1 P41143 2/20 0.32
OPRK1 P41145 2/20 0.32
SLC22A1 O15245 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32
KCNH2 Q12809 1/20 0.32
LMNA P02545 3/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL30706721 0.91 POLB (0.36) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL12057961 0.91 POLB (0.36) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL7392445 0.87 MAPK1 (0.36) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL7392441 0.87 MAPK1 (0.36) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL7392443 0.87 MAPK1 (0.36) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL15325061 0.87 MAPK1 (0.36) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL12037372 0.86 LMNA (0.35) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL7807553 0.84 ALOX15 (0.38) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL7807558 0.84 ALOX15 (0.38) OPRM1MAPK1SMN1; SMN2GAAPOLB
SCHEMBL8485985 0.84 ALOX15 (0.38) OPRM1MAPK1SMN1; SMN2GAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0845454-A1 Method for the production of optically active cyclopropane derivatives Ajinomoto Co., Inc. (JP) 1998-06-03 EP claimed
US-5900492-A Method of producing optically active cyclopropane derivatives AJINOMOTO CO., INC. (JP) 1999-05-04 US disclosed
EP-0845454-A1 Method for the production of optically active cyclopropane derivatives Ajinomoto Co., Inc. (JP) 1998-06-03 EP disclosed