SCHEMBL15948851

SCHEMBL15948851

CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(OC)OC)NC(=O)OC(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G4A P47712 5/20 0.60
▸ TP53 P04637 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ SMPD1 P17405 1/20 0.49
▸ S1PR4 O95977 2/20 0.46
▸ S1PR1 P21453 2/20 0.46
▸ S1PR3 Q99500 2/20 0.46
▸ S1PR5 Q9H228 2/20 0.46
▸ S1PR2 O95136 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ TSPO P30536 1/20 0.46
▸ TMEM97 Q5BJF2 1/20 0.46
▸ SIGMAR1 Q99720 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ CETP P11597 1/20 0.46

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
SCHEMBL15941659 1.00 PLA2G4A (0.60) PLA2G4ATP53CYP1A2CYP2D6MAPT
SCHEMBL15887073 0.88 PLA2G4A (0.47) PLA2G4ATP53CYP1A2CYP2D6MAPT
SCHEMBL17804033 0.86 PLA2G4A (0.48) PLA2G4ATP53CYP1A2CYP2D6MAPT
SCHEMBL20830129 0.84 CA1 (0.40) PLA2G4ACYP2D6SMPD1
SCHEMBL6419171 0.82 MAPT (0.74) TP53CYP1A2CYP2D6MAPTCYP2C9
SCHEMBL6410388 0.82 MAPT (0.74) TP53CYP1A2CYP2D6MAPTCYP2C9
SCHEMBL6410392 0.82 MAPT (0.74) TP53CYP1A2CYP2D6MAPTCYP2C9
SCHEMBL315529 0.82 MAPT (0.74) TP53CYP1A2CYP2D6MAPTCYP2C9
SCHEMBL10025150 0.82 MAPT (0.74) TP53CYP1A2CYP2D6MAPTCYP2C9
SCHEMBL12451652 0.82 MAPT (0.74) TP53CYP1A2CYP2D6MAPTCYP2C9

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024158254-A1 METHOD FOR PRODUCING N-BOC-SPHINGOSINE AND SPHINGOSINE-1-PHOSPHATE (주)유케이케미팜 2024-08-02 — — WO disclosed
US-11857560-B2 Pharmaceutical compositions comprising substituted nucleotides and nucleosides for treating viral infections EMORY UNIVERSITY (US) 2024-01-02 — — US disclosed
WO-2017189978-A1 ALKYNE CONTAINING NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2017-11-02 — — WO disclosed
WO-2017155923-A1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2017-09-14 — — WO disclosed
US-20160220595-A1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO DEFENSE THREAT REDUCTION AGENCY, US DOD 2016-08-04 — — 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
WO-2014124430-A1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2014-08-14 — — 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-20160220595-A1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO PNP, NTPCR, TYMP PLA2G4A 1260/4885TP53 693/4885CYP1A2 4521/4885
US-11857560-B2 Pharmaceutical compositions comprising substituted nucleotides and nucleosides for treating viral infections SLC28A1, PNP, SLC28A2 PLA2G4A 1829/4885TP53 994/4885CYP1A2 2594/4885

“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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