SCHEMBL3112433

SCHEMBL3112433

COC(=O)C1CCC(=O)CC1c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.47
SLC6A3 Q01959 4/20 0.47
SLC6A2 P23975 2/20 0.46

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
SCHEMBL3112422 1.00 SLC6A4 (0.47) SLC6A4SLC6A3SLC6A2
SCHEMBL3112421 1.00 SLC6A4 (0.47) SLC6A4SLC6A3SLC6A2
SCHEMBL3123712 0.89 SLC6A4 (0.47) SLC6A4SLC6A3
SCHEMBL3123706 0.89 SLC6A4 (0.47) SLC6A4SLC6A3
SCHEMBL3123700 0.89 SLC6A4 (0.47) SLC6A4SLC6A3
SCHEMBL16365793 0.86 SLC6A4 (0.47) SLC6A4SLC6A3SLC6A2
SCHEMBL12151967 0.86 SLC6A4 (0.47) SLC6A4SLC6A3SLC6A2
SCHEMBL15196794 0.86 SLC6A3 (0.53) SLC6A4SLC6A3SLC6A2
SCHEMBL22492077 0.86 SLC6A3 (0.53) SLC6A4SLC6A3SLC6A2
SCHEMBL22492074 0.86 SLC6A3 (0.53) SLC6A4SLC6A3SLC6A2

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-7700778-B2 Acylated piperidine derivatives as melanocortin-4 receptor agonists MERCK SHARP & DOHME CORP. (US) 2010-04-20 US disclosed
EP-1385506-B1 ACYLATED PIPERIDINE DERIVATES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO INC (US) 2009-05-06 EP disclosed
US-7012084-B2 Acylated piperidine derivatives as melanocortin-4 receptor agonists MERCK & CO., INC. (US) 2006-03-14 US disclosed
US-20060025442-A1 Acylated piperidine derivatives as melanocortin-4 receptor agonists MERCK SHARP & DOHME CORP. 2006-02-02 US disclosed
US-20040092501-A1 Acylated piperidine derivatives as melanocortin-4 receptor agonists MERCK SHARP & DOHME CORP. 2004-05-13 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 (2 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-20060025442-A1 Acylated piperidine derivatives as melanocortin-4 receptor agonists MC4R, MC5R, MC3R SLC6A4 371/4885SLC6A3 968/4885SLC6A2 1375/4885
US-20040092501-A1 Acylated piperidine derivatives as melanocortin-4 receptor agonists MC4R, MC5R, MC3R SLC6A4 371/4885SLC6A3 968/4885SLC6A2 1375/4885

“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.