SCHEMBL11294755

SCHEMBL11294755

O=C(NC[C@@H](O)C(=O)ON1C(=O)CCC1=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.44
TP53 P04637 1/20 0.44
GFER P55789 1/20 0.44
GAA P10253 1/20 0.43
CASP1 P29466 1/20 0.43
MAPT P10636 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FOLH1 Q04609 1/20 0.42
CTSL P07711 1/20 0.42
CTSS P25774 1/20 0.42
SYK P43405 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
GSK3B P49841 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL8897264 1.00 LMNA (0.46) LMNASMN1; SMN2MAPK1HTTTP53
SCHEMBL8897257 1.00 LMNA (0.46) LMNASMN1; SMN2MAPK1HTTTP53
SCHEMBL3462691 0.88 LMNA (0.50) LMNASMN1; SMN2HTTGAAMAPT
SCHEMBL2138925 0.88 LMNA (0.50) LMNASMN1; SMN2HTTGAAMAPT
SCHEMBL11291906 0.88 LMNA (0.50) LMNASMN1; SMN2HTTGAAMAPT
SCHEMBL11146434 0.86 ALDH1A1 (0.45) LMNASMN1; SMN2HTTGAAMAPT
SCHEMBL11294170 0.86 HTT (0.52) LMNASMN1; SMN2HTTGAAFOLH1
SCHEMBL11048769 0.86 HTT (0.52) LMNASMN1; SMN2HTTGAAFOLH1
SCHEMBL11310616 0.86 HTT (0.52) LMNASMN1; SMN2HTTGAAFOLH1
SCHEMBL11310220 0.84 LMNA (0.47) LMNASMN1; SMN2MAPK1HTTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4337335-A Transition metal salt complexes of polyamino organic compounds SCHERING CORPORATION (US) 1982-06-29 US disclosed
US-4283528-A 1-N-aminohydroxyacyl derivatives of gentamicin B SCHERING CORPORATION (US) 1981-08-11 US disclosed
US-4231945-A BACTERICIDES SCHERING CORPORATION (US) 1980-11-04 US disclosed
US-4230847-A Aminoglycoside antibiotic compounds SCHERING CORPORATION (US) 1980-10-28 US disclosed
US-4212860-A COUPLING THE PENTOFURANOSYL ONTO THE PROTECTED CYCLITOL SCHERING CORPORATION (US) 1980-07-15 US disclosed
US-4136254-A PROCESS OF SELECTIVELY BLOCKING AMINO FUNCTIONS IN AMINOGLYCOSIDES USING TRANSITION METAL SALTS AND INTERMEDIATES USED THEREBY SCHERING CORPORATION (US) 1979-01-23 US disclosed
US-4053591-A 5-DEOXY-4,6-DI-O-(AMINOGLYCOSYL)-1,3-DIAMINOCYCLITOLS, METHODS FOR THEIR MANUFACTURE, METHOD FOR THEIR USE AS ANTIBACTERIAL AGENTS AND COMPOSITIONS USEFUL THEREFOR SCHERING CORPORATION (US) 1977-10-11 US disclosed