SCHEMBL2761900

SCHEMBL2761900

NC(=O)C1C[CH]CCN1CCN1CCC(O)CC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.35
KCNA3 P22001 1/20 0.33
ARG1 P05089 2/20 0.33
ARG2 P78540 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HIF1A Q16665 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TERT O14746 2/20 0.32
LTA4H P09960 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL2762049 0.95 SMN1; SMN2 (0.33) SMN1; SMN2KCNA3ARG1ARG2ALDH1A1
SCHEMBL2761806 0.87 HTT (0.42) SMN1; SMN2ALDH1A1GAAKDM4EL3MBTL1
SCHEMBL2761794 0.85 L3MBTL1 (0.42) SMN1; SMN2ALDH1A1KDM4ELMNAMAPK1
SCHEMBL2761703 0.85 L3MBTL1 (0.42) SMN1; SMN2ALDH1A1KDM4ELMNAMAPK1
SCHEMBL2762015 0.84 ALDH1A1 (0.36) SMN1; SMN2ALDH1A1GAAKDM4EHRH3
SCHEMBL2762110 0.84 ALDH1A1 (0.36) SMN1; SMN2ALDH1A1GAAKDM4EHRH3
SCHEMBL2762057 0.84 ALDH1A1 (0.36) SMN1; SMN2ALDH1A1GAAKDM4EHRH3
SCHEMBL2762427 0.82 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL4394338 0.80 GBA1 (0.33)
SCHEMBL2761947 0.80 LMNA (0.31) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183366-B2 Chemokine receptor antagonists NOVARTIS AG (CH) 2012-05-22 US claimed
EP-1720859-B1 CHEMOKINE RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2009-12-23 EP claimed
US-20070155721-A1 Chemokine receptor antagonists NOVARTIS AG (CH) 2007-07-05 US claimed
EP-1720859-A2 CHEMOKINE RECEPTOR ANTAGONISTS Novartis AG (CH) 2006-11-15 EP claimed
WO-2005077932-A2 CHEMOKINE RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2005-08-25 WO claimed
US-8183366-B2 Chemokine receptor antagonists NOVARTIS AG (CH) 2012-05-22 US disclosed
US-7858781-B2 Chemokine receptor antagonists NOVARTIS AG (CH) 2010-12-28 US disclosed
EP-1720859-B1 CHEMOKINE RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2009-12-23 EP disclosed
US-20070155721-A1 Chemokine receptor antagonists NOVARTIS AG (CH) 2007-07-05 US disclosed
EP-1720859-A2 CHEMOKINE RECEPTOR ANTAGONISTS Novartis AG (CH) 2006-11-15 EP disclosed
WO-2005077932-A2 CHEMOKINE RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2005-08-25 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-20070155721-A1 Chemokine receptor antagonists ACKR3, CXCR2, CXCR4 SMN1; SMN2 4263/4885KCNA3 2172/4885ARG1 600/4885

“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.