SCHEMBL20714244

SCHEMBL20714244

CCCCCCC(=O)N[C@@H](CCN)C(=O)N[C@H](C(=O)N[C@@H](CCN)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCN)C(=O)N[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O)C(C)C)C(C)C

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 2/20 0.57
▸ PSMB5 P28074 3/20 0.56
▸ NPY4R P50391 4/20 0.51
▸ NPY5R Q15761 4/20 0.51
▸ NPY1R P25929 3/20 0.51
▸ NPY2R P49146 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ OPRD1 P41143 1/20 0.51
▸ OPRK1 P41145 1/20 0.51
▸ CTSD P07339 1/20 0.49
▸ HRH1 P35367 1/20 0.48
▸ CTSB P07858 1/20 0.48

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
SCHEMBL20714185 1.00 KISS1R (0.57) KISS1RPSMB5NPY4RNPY5RNPY1R
SCHEMBL20714226 0.96 KISS1R (0.54) KISS1RPSMB5NPY4RNPY5RNPY1R
SCHEMBL23331147 0.96 KISS1R (0.54) KISS1RPSMB5NPY4RNPY5RNPY1R
SCHEMBL20714303 0.96 KISS1R (0.54) KISS1RPSMB5NPY4RNPY5RNPY1R
SCHEMBL23331359 0.96 KISS1R (0.59) KISS1RPSMB5NPY4RNPY5RNPY1R
SCHEMBL20714183 0.95 KISS1R (0.55) KISS1RPSMB5CTSD
SCHEMBL23330990 0.95 KISS1R (0.62) KISS1RPSMB5NPY4RNPY5RNPY1R
SCHEMBL20714299 0.95 KISS1R (0.62) KISS1RPSMB5NPY4RNPY5RNPY1R
SCHEMBL20714498 0.94 KISS1R (0.56) KISS1RPSMB5NPY4RNPY5RNPY1R
SCHEMBL20714227 0.92 KISS1R (0.56) KISS1RPSMB5NPY4RNPY5RNPY1R

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-11364275-B2 Linear lipopeptide paenipeptins and methods of using the same BIOVENTURES, LLC (US) 2022-06-21 — — US disclosed
US-20210128669-A1 LINEAR LIPOPEPTIDE PAENIPEPTINS AND METHODS OF USING THE SAME BIOVENTURES, LLC (US) 2021-05-06 — — US disclosed
WO-2019028463-A1 LINEAR LIPOPEPTIDE PAENIPEPTINS AND METHODS OF USING THE SAME BIOVENTURES, LLC (US) 2019-02-07 — — 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-11364275-B2 Linear lipopeptide paenipeptins and methods of using the same NGLY1, VIP, CLPTM1 KISS1R 1143/4885PSMB5 2450/4885NPY4R 1204/4885
US-20210128669-A1 LINEAR LIPOPEPTIDE PAENIPEPTINS AND METHODS OF USING THE SAME NGLY1, VIP, CLPTM1 KISS1R 1143/4885PSMB5 2450/4885NPY4R 1204/4885

“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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