SCHEMBL4781176

SCHEMBL4781176

CC(C)N(Cc1ccc2c(c1)CCC(C(N)=O)C2)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 8/20 0.42
DRD2 P14416 6/20 0.42
MCHR1 Q99705 8/20 0.39
KCNH2 Q12809 6/20 0.39
HTR2C P28335 4/20 0.39
F2 P00734 4/20 0.38
PRSS1 P07477 1/20 0.38

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
SCHEMBL4778925 0.86 HRH3 (0.47) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL4792233 0.86 DRD3 (0.44) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL4779647 0.84 DRD3 (0.42) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL4725409 0.81 MCHR1 (0.52) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL4793677 0.81 MCHR1 (0.52) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL5935171 0.81 DRD3 (0.42) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL5633815 0.80 DRD3 (0.42) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL4794868 0.80 DRD3 (0.41) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL4781349 0.79 DRD3 (0.46) DRD3DRD2MCHR1KCNH2HTR2C
SCHEMBL5634328 0.79 DRD3 (0.46) DRD3DRD2MCHR1KCNH2HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008001160-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS THE PROCTER & GAMBLE COMPANY (US) 2008-01-03 WO claimed
US-20060247239-A1 Melanin concentrating hormone antagonists HU XIUFENG E 2006-11-02 US claimed
WO-2008001160-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS THE PROCTER & GAMBLE COMPANY (US) 2008-01-03 WO disclosed
US-20060247239-A1 Melanin concentrating hormone antagonists HU XIUFENG E 2006-11-02 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-20060247239-A1 Melanin concentrating hormone antagonists MCHR1, MCHR2, MC1R DRD3 102/4885DRD2 96/4885MCHR1 1/4885

“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.