SCHEMBL4035790

SCHEMBL4035790

CCC(CN)[C@@H]1CCCN1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 13/20 0.39
SLC6A3 Q01959 13/20 0.39
SLC6A4 P31645 12/20 0.39
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL4038090 1.00 SLC6A2 (0.39) SLC6A2SLC6A3SLC6A4HIF1AHSD17B10
SCHEMBL14999472 0.94 SLC6A2 (0.45) SLC6A2SLC6A3SLC6A4HIF1AHSD17B10
SCHEMBL26725297 0.89 SLC6A2 (0.42) SLC6A2SLC6A3SLC6A4HIF1AHSD17B10
SCHEMBL12965781 0.89 SLC6A2 (0.42) SLC6A2SLC6A3SLC6A4HIF1AHSD17B10
SCHEMBL21567213 0.83 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4HIF1AHSD17B10
SCHEMBL19622233 0.82 SLC6A2 (0.43) SLC6A2SLC6A3SLC6A4
SCHEMBL4829491 0.77
SCHEMBL6109208 0.77
SCHEMBL20960624 0.77 SLC6A2 (0.45) SLC6A2SLC6A3SLC6A4
SCHEMBL4651632 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404690-B2 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2013-03-26 US disclosed
EP-1592389-B1 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES SERONO LAB (CH) 2009-04-22 EP disclosed
US-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 US disclosed
EP-1592389-A2 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES Applied Research Systems ARS Holding N.V. (AN) 2005-11-09 EP disclosed
WO-2004071390-A2 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-08-26 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-20070142391-A1 Piperazine-2-carboxamide derivatives P2RX5, P2RX2, NPY5R SLC6A2 4285/4885SLC6A3 4589/4885SLC6A4 3812/4885

“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.