SCHEMBL27429144

SCHEMBL27429144

CN(CC(N)=O)C(=O)[C@H](Cc1cccnc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCC(=O)OP

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 5/20 0.40
▸ BACE1 P56817 7/20 0.38
▸ CTSD P07339 1/20 0.35
▸ MMP9 P14780 1/20 0.34
▸ MMP8 P22894 1/20 0.34
▸ MMP12 P39900 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NLRP3 Q96P20 1/20 0.34
▸ CTSL P07711 1/20 0.34
▸ CTSB P07858 1/20 0.34

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
SCHEMBL27430671 0.92 KISS1R (0.36) KISS1RMMP9MMP8MMP12LMNA
SCHEMBL27430678 0.92 KISS1R (0.36) KISS1RMMP9MMP8MMP12LMNA
SCHEMBL30724708 0.91 BACE1 (0.45) KISS1RBACE1CTSDMMP9MMP8
SCHEMBL27429147 0.91 KISS1R (0.37) KISS1RMMP9MMP8MMP12LMNA
SCHEMBL27428793 0.90 KISS1R (0.39) KISS1RBACE1CTSDCTSLCTSB
SCHEMBL27389168 0.90 KISS1R (0.39) KISS1RBACE1CTSDCTSLCTSB
SCHEMBL30918360 0.90 KISS1R (0.39) KISS1RBACE1CTSDCTSLCTSB
SCHEMBL27428938 0.90 KISS1R (0.43) KISS1RBACE1CTSDMMP9MMP8
SCHEMBL27429704 0.89 MMP12 (0.36) KISS1RMMP9MMP8MMP12LMNA
SCHEMBL27430986 0.88 KISS1R (0.39) KISS1RBACE1CTSLCTSB

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-20240218014-A1 SYNTHESIS OF A CYCLIC PEPTIDE JANSSEN PHARMACEUTICA NV (BE) 2024-07-04 — — 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-20240218014-A1 SYNTHESIS OF A CYCLIC PEPTIDE VIP, QPCT, PTMS KISS1R 1618/4885BACE1 1969/4885CTSD 1327/4885

“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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