SCHEMBL17972404

SCHEMBL17972404

CCCCCCCCCCCCCC[C@H]1OC(C)(C)O[C@H]1[C@H](COP(=O)(O)O)NC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 4/20 0.44
▸ PLA2G4A P47712 2/20 0.42
▸ ENPP2 Q13822 6/20 0.39
▸ LPAR1 Q92633 3/20 0.39
▸ LPAR3 Q9UBY5 3/20 0.39
▸ LPAR6 P43657 1/20 0.39
▸ LPAR4 Q99677 1/20 0.39
▸ LPAR5 Q9H1C0 1/20 0.39
▸ LPAR2 Q9HBW0 1/20 0.39
▸ S1PR2 O95136 2/20 0.38
▸ S1PR1 P21453 2/20 0.38
▸ S1PR3 Q99500 2/20 0.38
▸ S1PR5 Q9H228 1/20 0.38
▸ PGD P52209 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL17972403 0.89 PLA2G2A (0.45) PLA2G2APLA2G4A
SCHEMBL17976777 0.88 S1PR1 (0.40) PLA2G4AENPP2LPAR1LPAR3LPAR6
SCHEMBL17174997 0.83 DAGLA (0.37) PLA2G2A
SCHEMBL17174995 0.81 CNR1 (0.36) PLA2G2A
SCHEMBL17976780 0.78 PLA2G2A (0.35) PLA2G2APLA2G4AS1PR2S1PR1S1PR3
SCHEMBL17972402 0.75 CTSK (0.39) SMN1; SMN2
SCHEMBL15948704 0.74 EPHX1 (0.35) PLA2G2A
SCHEMBL16367514 0.72 PLA2G4A (0.34) PLA2G4A
SCHEMBL19101045 0.72 PLA2G4A (0.34) PLA2G4A
SCHEMBL31303197 0.71 MEN1 (0.44) PLA2G4A

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-11857560-B2 Pharmaceutical compositions comprising substituted nucleotides and nucleosides for treating viral infections EMORY UNIVERSITY (US) 2024-01-02 — — US disclosed
US-20160220595-A1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO DEFENSE THREAT REDUCTION AGENCY, US DOD 2016-08-04 — — 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 (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-20160220595-A1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO PNP, NTPCR, TYMP PLA2G2A 1701/4885PLA2G4A 1260/4885ENPP2 349/4885
US-11857560-B2 Pharmaceutical compositions comprising substituted nucleotides and nucleosides for treating viral infections SLC28A1, PNP, SLC28A2 PLA2G2A 2169/4885PLA2G4A 1829/4885ENPP2 1509/4885

“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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