SCHEMBL590358

SCHEMBL590358

O=C(NCCC(O)CO)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
SLC1A3 P43003 1/20 0.59
SLC1A1 P43005 1/20 0.59
HTT P42858 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.54
TGM2 P21980 1/20 0.52
KEAP1 Q14145 2/20 0.51
NFE2L2 Q16236 2/20 0.51
FOLH1 Q04609 2/20 0.50
MAPT P10636 1/20 0.50
CTRB1 P17538 2/20 0.49
DPP8 Q6V1X1 1/20 0.48
DPP7 Q9UHL4 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KCNA5 P22460 1/20 0.47

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
SCHEMBL735078 1.00 LMNA (0.61) LMNASMN1; SMN2SLC1A3SLC1A1HTT
SCHEMBL734427 1.00 LMNA (0.61) LMNASMN1; SMN2SLC1A3SLC1A1HTT
SCHEMBL4618949 0.92 HTT (0.63) LMNASMN1; SMN2SLC1A3SLC1A1HTT
SCHEMBL22171710 0.90 HTT (0.62) LMNASMN1; SMN2HTTTGM2KEAP1
SCHEMBL3701581 0.90 LMNA (0.60) LMNASMN1; SMN2SLC1A3SLC1A1HTT
SCHEMBL18667866 0.87 LMNA (0.60) LMNASMN1; SMN2SLC1A3SLC1A1HTT
SCHEMBL7775648 0.87 HTT (0.61) LMNASMN1; SMN2SLC1A3SLC1A1HTT
SCHEMBL7775652 0.87 HTT (0.61) LMNASMN1; SMN2SLC1A3SLC1A1HTT
SCHEMBL18667208 0.87 LMNA (0.60) LMNASMN1; SMN2SLC1A3SLC1A1HTT
SCHEMBL7752769 0.86 LMNA (0.67) LMNASMN1; SMN2SLC1A3SLC1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146987-B1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2015-12-02 EP disclosed
CN-104302634-A Benzamide derivatives for inhibiting the activity of ABL1, ABL2 and BCR-ABL1 NOVARTIS AG 2015-01-21 CN disclosed
US-8138175-B2 Heterocyclyl compounds HOFFMANN-LA ROCHE INC. (US) 2012-03-20 US disclosed
US-8114867-B2 Oxazolidinone antibiotic derivatives ACTELION PHARMACEUTICALS LTD (CH) 2012-02-14 US disclosed
EP-2321285-A1 DIAZEPAN AND PIPERAZINE DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS F. Hoffmann-La Roche AG (CH) 2011-05-18 EP disclosed
US-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-06-03 US disclosed
WO-2010012619-A1 DIAZEPAN AND PIPERAZINE DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS F. HOFFMANN-LA ROCHE AG (CH) 2010-02-04 WO disclosed
US-20100022518-A1 NOVEL HETEROCYCLYL COMPOUNDS HOFFMANN-LA ROCHE, INC. 2010-01-28 US disclosed
EP-2146987-A2 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2010-01-27 EP disclosed
WO-2008126024-A2 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-10-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES OXA1L, XDH, CCNY LMNA 2322/4885SMN1; SMN2 2745/4885SLC1A3 3938/4885
US-20100022518-A1 NOVEL HETEROCYCLYL COMPOUNDS CCR2, CCR3, CCR5 LMNA 3760/4885SMN1; SMN2 4455/4885SLC1A3 1680/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.