SCHEMBL13359249

SCHEMBL13359249

CCNC(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.61
ALDH1A1 P00352 1/20 0.55
KMT2A Q03164 4/20 0.53
POLB P06746 1/20 0.53
NPC1 O15118 1/20 0.52
MEN1 O00255 3/20 0.51
LMNA P02545 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
SCN5A Q14524 1/20 0.49
SCN3A Q9NY46 1/20 0.49
HSD17B10 Q99714 1/20 0.49
FKBP5 Q13451 1/20 0.46
SCN4A P35499 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
FKBP1A P62942 1/20 0.44

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
SCHEMBL13990634 1.00 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL13990630 0.96 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL12072337 0.96 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL617770 0.96 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL1512973 0.86 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL21013765 0.85 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL24648736 0.85 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL15244828 0.85 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL5898624 0.85 KMT2A (0.57) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL26039743 0.84 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1KMT2APOLBNPC1

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-1874739-B1 PHARMACEUTICALLY ACTIVE DIAZEPANES NOVARTIS AG (CH) 2010-05-26 EP disclosed
US-20080300237-A1 Pharmaceutically Active Diazepanes OBERHAUSER BERNDT 2008-12-04 US disclosed
US-20080300237-A1 Pharmaceutically Active Diazepanes OBERHAUSER BERNDT 2008-12-04 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-20080300237-A1 Pharmaceutically Active Diazepanes VCAM1, ICAM1, CD69 SMN1; SMN2 2571/4885ALDH1A1 137/4885KMT2A 2594/4885

“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.