SCHEMBL23331574

SCHEMBL23331574

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

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 9/20 0.55
▸ KISS1R Q969F8 2/20 0.54
▸ BACE1 P56817 3/20 0.54
▸ BACE2 Q9Y5Z0 1/20 0.54

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
SCHEMBL23331572 1.00 CTSD (0.55) CTSDKISS1RBACE1BACE2
SCHEMBL23331377 0.94 KISS1R (0.57) CTSDKISS1RBACE1BACE2
SCHEMBL23331375 0.93 CTSD (0.54) CTSDKISS1RBACE1BACE2
SCHEMBL23331376 0.93 CTSD (0.54) CTSDKISS1RBACE1BACE2
SCHEMBL30912314 0.92 KISS1R (0.58) CTSDKISS1RBACE1BACE2
SCHEMBL23330932 0.90 CTSD (0.56) CTSD
SCHEMBL23331567 0.90 CTSD (0.50) CTSDKISS1RBACE1BACE2
SCHEMBL23331564 0.89 CTSD (0.51) CTSDKISS1R
SCHEMBL23331576 0.89 CDK4 (0.52) CTSDKISS1R
Kklfkkilkvl-Nh2 SCHEMBL30396617 0.89 NTSR2 (0.55) CTSDKISS1RBACE1BACE2

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 2 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

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 CTSD 1815/4885KISS1R 1143/4885BACE1 1709/4885
US-20210128669-A1 LINEAR LIPOPEPTIDE PAENIPEPTINS AND METHODS OF USING THE SAME NGLY1, VIP, CLPTM1 CTSD 1815/4885KISS1R 1143/4885BACE1 1709/4885

“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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