SCHEMBL3580688

SCHEMBL3580688

CN(C)CCNC(=O)C(N)COCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SLC1A1 P43005 1/20 0.48
ALOX5 P09917 1/20 0.41
KIF11 P52732 1/20 0.41
CTSS P25774 1/20 0.41
TACR1 P25103 2/20 0.40

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
SCHEMBL3580682 1.00 HTT (0.50) HTTSMN1; SMN2SLC1A1ALOX5KIF11
SCHEMBL3586820 0.84 SLC1A1 (0.52) HTTSMN1; SMN2SLC1A1TACR1
SCHEMBL14868416 0.83 SMN1; SMN2 (0.44) HTTSMN1; SMN2SLC1A1CTSS
SCHEMBL357189 0.82 ALPI (0.51)
SCHEMBL5209733 0.82 SLC1A1 (0.48) HTTSMN1; SMN2SLC1A1CTSSTACR1
Hydrochloric Acid SCHEMBL6895415 0.81 ALPI (0.50)
SCHEMBL1576805 0.81 SLC1A1 (0.55) HTTSMN1; SMN2SLC1A1TACR1
SCHEMBL14580892 0.80 SLC1A1 (0.54) HTTSMN1; SMN2SLC1A1TACR1
SCHEMBL13165228 0.80 SLC1A1 (0.54) HTTSMN1; SMN2SLC1A1TACR1
SCHEMBL23740204 0.80 SLC1A1 (0.48) HTTSMN1; SMN2SLC1A1TACR1

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-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 Wurster, Siegfried (FI) 2010-02-25 US disclosed
EP-1885693-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 Wurster, Siegfried (FI) 2008-02-13 EP disclosed
WO-2006123020-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 JUVANTIA PHARMA LTD OY (FI) 2006-11-23 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 (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-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 SSTR1, SSTR4, SSTR3 HTT 1383/4885SMN1; SMN2 2171/4885SLC1A1 465/4885

“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.