SCHEMBL5966682

SCHEMBL5966682

N=C(N)NCCCC(NC(=O)C(Cc1ccccc1)NCCCc1ccccc1)C(=O)NCc1cccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 4/20 0.49
▸ PSMB8 P28062 3/20 0.49
▸ SIGMAR1 Q99720 2/20 0.45
▸ F2 P00734 1/20 0.44
▸ CTSL P07711 2/20 0.44
▸ MCHR1 Q99705 1/20 0.44
▸ KMT2A Q03164 1/20 0.43
▸ MMP1 P03956 1/20 0.42
▸ FCER2 P06734 1/20 0.42
▸ REN P00797 1/20 0.42
▸ LCK P06239 1/20 0.42
▸ EPHX2 P34913 2/20 0.41
▸ HRH4 Q9H3N8 1/20 0.41

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
SCHEMBL5966627 0.91 MMP1 (0.48) CTSLMMP1FCER2EPHX2
SCHEMBL5966579 0.86 PSMB5 (0.46) PSMB5PSMB8SIGMAR1F2CTSL
SCHEMBL5966704 0.84 GNPAT (0.50) CTSLMMP1
SCHEMBL5966616 0.84 GNPAT (0.50) CTSLMMP1
SCHEMBL5966623 0.84 GNPAT (0.50) CTSLMMP1
SCHEMBL16899187 0.79 PSMB5 (0.65) PSMB5PSMB8SIGMAR1MMP1FCER2
SCHEMBL16899266 0.79 PSMB5 (0.65) PSMB5PSMB8SIGMAR1MMP1FCER2
SCHEMBL5966647 0.79 CTSL (0.40) PSMB5PSMB8SIGMAR1F2CTSL
SCHEMBL7370024 0.78 PSMB5 (0.46) PSMB5HRH4
SCHEMBL16899184 0.76 PSMB8 (0.64) PSMB5PSMB8SIGMAR1F2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060128613-A1 Melanocortin receptor ligands THE PROCTER & GAMBLE COMPANY 2006-06-15 — — 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-20060128613-A1 Melanocortin receptor ligands MC3R, MC4R, MC1R PSMB5 2300/4885PSMB8 2455/4885SIGMAR1 543/4885

“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.

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