SCHEMBL5339608

SCHEMBL5339608

CC(C)CN(N)c1ccccc1N1CCN(C(=O)C(N)Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 11/20 0.56
MC4R P32245 8/20 0.56
AKT2 P31751 1/20 0.52
AKT1S1 Q96B36 1/20 0.52
AKT3 Q9Y243 1/20 0.52

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
SCHEMBL5475956 0.83 MC4R (0.62) AKT1MC4R
SCHEMBL5478550 0.79 MC4R (0.59) AKT1MC4R
SCHEMBL14355905 0.79 AKT1 (0.59) AKT1MC4RAKT2AKT1S1AKT3
SCHEMBL4515320 0.79 MC4R (0.63) AKT1MC4RAKT2AKT1S1AKT3
SCHEMBL7095030 0.79 MC4R (0.69) MC4R
SCHEMBL5483959 0.78 MC4R (0.63) AKT1MC4RAKT2AKT1S1AKT3
Hydrochloric Acid SCHEMBL4516761 0.78 AKT1 (0.58) AKT1MC4RAKT2AKT1S1AKT3
SCHEMBL4510620 0.78 MC4R (0.75) AKT1MC4R
SCHEMBL4677791 0.78 MC4R (0.75) AKT1MC4R
SCHEMBL14355904 0.78 AKT1 (0.60) AKT1MC4RAKT2AKT1S1AKT3

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-7291619-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-11-06 US disclosed
EP-1368340-B1 PIPERAZINE DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS LILLY CO ELI (US) 2005-08-10 EP disclosed
US-20040092507-A1 Melanocortin receptor agonists ELI LILLY AND COMPANY 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 (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-20040092507-A1 Melanocortin receptor agonists MC1R, MC4R, MC5R AKT1 3558/4885MC4R 2/4885AKT2 3899/4885

“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.