SCHEMBL2276334

SCHEMBL2276334

COC(=O)CN(C1CCCCC1)C1CCNC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 0.39
SLC6A2 P23975 17/20 0.39
SLC6A3 Q01959 13/20 0.39
KCNH2 Q12809 4/20 0.39
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP2D6 P10635 3/20 0.37
EPHX2 P34913 1/20 0.35

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
SCHEMBL2276331 1.00 SLC6A4 (0.39) SLC6A4SLC6A2SLC6A3KCNH2GAA
SCHEMBL7296171 0.86 NPSR1 (0.46) GAANPSR1EPHX2
SCHEMBL18494973 0.84 EPHX1 (0.34) SLC6A4SLC6A2SLC6A3GAANPSR1
SCHEMBL18469983 0.84 NPSR1 (0.45) GAANPSR1CYP2D6EPHX2
Hydrochloric Acid SCHEMBL28933506 0.83 GNAI3 (0.33) SLC6A4SLC6A2SLC6A3GAANPSR1
SCHEMBL8484000 0.74 ALDH1A1 (0.35) SLC6A4SLC6A2SLC6A3CYP2D6EPHX2
Hydrochloric Acid SCHEMBL8483997 0.73 L3MBTL1 (0.36) SLC6A4SLC6A2SLC6A3CYP2D6EPHX2
SCHEMBL24359375 0.73 GAA (0.44) GAANPSR1CYP2D6
SCHEMBL4646897 0.73 SLC6A2 (0.42) SLC6A4SLC6A2GAANPSR1
SCHEMBL6628285 0.72 L3MBTL1 (0.46) NPSR1EPHX2

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-7989634-B2 Melanocortin receptor agonists LG LIFE SCIENCES LTD. (KR) 2011-08-02 US disclosed
EP-1685102-A4 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCES LTD (KR) 2008-08-20 EP disclosed
US-20070129346-A1 Melanocortin receptor agonists LG LIFE SCIENCES LTD. (KR) 2007-06-07 US disclosed
EP-1685102-A1 MELANOCORTIN RECEPTOR AGONISTS LG Life Sciences Ltd. (KR) 2006-08-02 EP disclosed
WO-2005047251-A1 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCES LTD. (KR) 2005-05-26 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-20070129346-A1 Melanocortin receptor agonists MC1R, MC3R, MC5R SLC6A4 386/4885SLC6A2 272/4885SLC6A3 286/4885

“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.