SCHEMBL9425855

SCHEMBL9425855

CCOC(=O)N[C@@H](C)C=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
GAA P10253 2/20 0.39
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 2/20 0.37
CTSK P43235 3/20 0.37
TRPM8 Q7Z2W7 1/20 0.36
ATM Q13315 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ACACB O00763 1/20 0.35
ALOX15 P16050 1/20 0.34
SOAT1 P35610 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL1999790 1.00 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHTTGAAMGAM
SCHEMBL28166553 0.82 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHTTGAAMGAM
SCHEMBL8491330 0.81 CTSK (0.47) SMN1; SMN2ALDH1A1CTSKATM
SCHEMBL9540332 0.81 CTSK (0.47) SMN1; SMN2ALDH1A1CTSKATM
SCHEMBL1999310 0.80 SMN1; SMN2 (0.40) SMN1; SMN2LMNAHTTGAAMGAM
SCHEMBL1995121 0.80 SMN1; SMN2 (0.40) SMN1; SMN2LMNAHTTGAAMGAM
SCHEMBL8758499 0.78
SCHEMBL2344865 0.78 SMN1; SMN2 (0.46) SMN1; SMN2LMNAHTTGAAMGAM
SCHEMBL906813 0.78
SCHEMBL1995107 0.78

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
US-5371086-A Circulatory disorders side effect reduction THE GREEN CROSS CORPORATION (JP) 1994-12-06 US disclosed
US-5262415-A FOR TREATING DISEASES OF THE CIRCULATORY SYSTEM THE GREEN CROSS CORPORATION (JP) 1993-11-16 US disclosed
EP-0503627-A1 Aminopyridine compounds THE GREEN CROSS CORPORATION (JP) 1992-09-16 EP disclosed