SCHEMBL5844838

SCHEMBL5844838

C=CCC1CC(OCc2ccccc2)CN1C(=O)C(N)Cc1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MC3R P41968 5/20 0.53
MC4R P32245 4/20 0.53
MC1R Q01726 4/20 0.53
DPP4 P27487 8/20 0.47
FAP Q12884 5/20 0.47
DPP8 Q6V1X1 5/20 0.47
DPP9 Q86TI2 5/20 0.47
DPP7 Q9UHL4 5/20 0.47
BDKRB2 P30411 2/20 0.42
AGTR2 P50052 1/20 0.41
OPRM1 P35372 2/20 0.39
OPRD1 P41143 2/20 0.39
F2 P00734 1/20 0.39
PRSS1 P07477 1/20 0.39

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
SCHEMBL13835262 0.82 MC4R (0.55) MC3RMC4RMC1RDPP4FAP
SCHEMBL5844869 0.82 PABPC1 (0.47) MC3RMC4RMC1RF2PRSS1
SCHEMBL16272846 0.80 MC4R (0.52) MC3RMC4RMC1RDPP4FAP
SCHEMBL3127940 0.75 DPP4 (0.55) DPP4FAPDPP8DPP9DPP7
SCHEMBL5843211 0.75 ABCB1 (0.45) MC3RMC4RMC1ROPRD1
SCHEMBL5846478 0.74 BDKRB2 (0.41) MC3RMC4RMC1RBDKRB2
SCHEMBL178628 0.74 ABCB1 (0.44) BDKRB2F2
SCHEMBL5844739 0.73 ABCB1 (0.57) BDKRB2F2
SCHEMBL5844741 0.73 ABCB1 (0.57) BDKRB2F2
SCHEMBL15693296 0.73 MC4R (0.55) MC3RMC4RMC1RDPP4FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1556361-A2 2-ALKYL-(2-AMINO-3-ARYL-PROPIONYL)-PIPERAZINE DERIVATIVES AND RELATED COMPOUNDS AS MELANOCORTIN RECEPTOR LIGANDS FOR THE TREATMENT OF OBESITY THE PROCTER & GAMBLE COMPANY (US) 2005-07-27 EP claimed
US-20050010031-A1 Melanocortin receptor ligands THE PROCTER & GAMBLE COMPANY 2005-01-13 US claimed
WO-2004037797-A2 2 - ALKYL - (2 - AMINO - 3 - ARYL - PROPIONYL) - PIPERAZINE DERIVATIVES AND RELATED COMPOUNDS AS MELANOCORTIN RECEPTOR LIGANDS FOR THE TREATMENT OF OBESITY THE PROCTER & GAMBLE COMPANY (US) 2004-05-06 WO claimed
US-7132539-B2 Melanocortin receptor ligands THE PROCTER & GAMBLE COMPANY (US) 2006-11-07 US disclosed
US-20060247224-A1 Melanocortin receptor ligands THE PROCTER & GAMBLE COMPANY 2006-11-02 US disclosed
EP-1556361-A2 2-ALKYL-(2-AMINO-3-ARYL-PROPIONYL)-PIPERAZINE DERIVATIVES AND RELATED COMPOUNDS AS MELANOCORTIN RECEPTOR LIGANDS FOR THE TREATMENT OF OBESITY THE PROCTER & GAMBLE COMPANY (US) 2005-07-27 EP disclosed
US-20050010031-A1 Melanocortin receptor ligands THE PROCTER & GAMBLE COMPANY 2005-01-13 US disclosed
WO-2004037797-A2 2 - ALKYL - (2 - AMINO - 3 - ARYL - PROPIONYL) - PIPERAZINE DERIVATIVES AND RELATED COMPOUNDS AS MELANOCORTIN RECEPTOR LIGANDS FOR THE TREATMENT OF OBESITY THE PROCTER & GAMBLE COMPANY (US) 2004-05-06 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 (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-20050010031-A1 Melanocortin receptor ligands MC3R, MC5R, MC1R MC3R 1/4885MC4R 8/4885MC1R 3/4885
US-20060247224-A1 Melanocortin receptor ligands MC3R, MC5R, MC1R MC3R 1/4885MC4R 8/4885MC1R 3/4885

“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.