SCHEMBL3979047

SCHEMBL3979047

CCOC(=O)C1CCCCN1C(=O)c1cc(C(=O)c2c(-c3ccccc3)noc2C)c[nH]1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
KDM4E B2RXH2 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.49
HTT P42858 2/20 0.49
KMT2A Q03164 2/20 0.46
TSHR P16473 3/20 0.46
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
POLB P06746 2/20 0.42
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
USP2 O75604 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
SCHEMBL3977513 0.82 LMNA (0.56) LMNAL3MBTL1KDM4ESMN1; SMN2HTT
SCHEMBL3977520 0.82 LMNA (0.56) LMNAL3MBTL1KDM4ESMN1; SMN2HTT
SCHEMBL13842379 0.82 LMNA (0.56) LMNAL3MBTL1KDM4ESMN1; SMN2HTT
SCHEMBL13842384 0.81 KMT2A (0.68) LMNAL3MBTL1KDM4ESMN1; SMN2HTT
SCHEMBL13842393 0.80 HTT (0.49) LMNAL3MBTL1KDM4ESMN1; SMN2HTT
SCHEMBL13842392 0.80 KMT2A (0.67) LMNAL3MBTL1KDM4ESMN1; SMN2HTT
SCHEMBL3981722 0.79 KDM4E (0.53) LMNAL3MBTL1KDM4ESMN1; SMN2HTT
SCHEMBL3981719 0.79 KDM4E (0.53) LMNAL3MBTL1KDM4ESMN1; SMN2HTT
SCHEMBL13842378 0.78 KMT2A (0.54) LMNAKDM4ESMN1; SMN2HTTKMT2A
SCHEMBL3978061 0.76 GABRA5 (0.53) LMNAL3MBTL1KDM4ESMN1; SMN2HTT

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-7538132-B2 Isoxazolo derivatives HOFFMAN-LA ROCHE INC. (US) 2009-05-26 US disclosed
EP-1931661-B1 ISOXAZOLO DERIVATIVES AS GABA A ALPHA5 INVERSE AGONISTS HOFFMANN LA ROCHE (CH) 2008-11-19 EP disclosed
US-20070066668-A1 Isoxazolo derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-03-22 US 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 (1 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-20070066668-A1 Isoxazolo derivatives GABRA5, GABRA4, GABRA1 LMNA 4188/4885L3MBTL1 3951/4885KDM4E 1310/4885

“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.