SCHEMBL25034528

SCHEMBL25034528

C=CCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1C(COP(=O)(O)O[C@@H]2C[C@H](n3ccc(N)nc3=O)OC2COP(=O)(O)O)OC(n2cnc3c(N)ncnc32)C1O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ENPP1 P22413 1/20 0.46
▸ RNASEL Q05823 7/20 0.43
▸ P2RX3 P56373 2/20 0.42
▸ P2RX4 Q99571 2/20 0.42
▸ P2RX2 Q9UBL9 2/20 0.42
▸ P2RX6 O15547 1/20 0.42
▸ P2RX1 P51575 1/20 0.42
▸ P2RX5 Q93086 1/20 0.42
▸ P2RY11 Q96G91 1/20 0.42
▸ P2RX7 Q99572 1/20 0.42
▸ AURKA O14965 1/20 0.40

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
SCHEMBL22348916 1.00 ENPP1 (0.46) ENPP1RNASELP2RX3P2RX4P2RX2
SCHEMBL22348933 0.95 ENPP1 (0.45) ENPP1RNASELP2RX3P2RX4P2RX2
SCHEMBL17948724 0.95 ENPP1 (0.45) ENPP1RNASELP2RX3P2RX4P2RX2
SCHEMBL22348902 0.95 ENPP1 (0.45) ENPP1RNASELP2RX3P2RX4P2RX2
SCHEMBL17948712 0.94 ENPP1 (0.45) ENPP1RNASELP2RX3P2RX4P2RX2
SCHEMBL22348928 0.94 ENPP1 (0.45) ENPP1RNASELP2RX3P2RX4P2RX2
SCHEMBL22348927 0.94 ENPP1 (0.45) ENPP1RNASELP2RX3P2RX4P2RX2
SCHEMBL16568374 0.93 RNASEL (0.44) ENPP1RNASEL
SCHEMBL16568365 0.93 RNASEL (0.44) ENPP1RNASEL
SCHEMBL15083421 0.93 RNASEL (0.44) ENPP1RNASEL

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-20230046194-A1 Ribosome-Mediated Incorporation of Peptides and Peptidomimetics ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2023-02-16 — — 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-20230046194-A1 Ribosome-Mediated Incorporation of Peptides and Peptidomimetics NPEPPS, DNPEP, AARS1 ENPP1 2802/4885RNASEL 663/4885P2RX3 2976/4885

“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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