SCHEMBL23014745

SCHEMBL23014745

COc1ccc(COCCCC(=O)N(C)OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.54
L3MBTL1 Q9Y468 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
FFAR1 O14842 1/20 0.43
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
F2RL1 P55085 1/20 0.41
GAA P10253 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
APP P05067 2/20 0.40
HPGD P15428 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
SCHEMBL8240649 0.86 L3MBTL1 (0.44) ALOX5L3MBTL1TDP1HTTALDH1A1
SCHEMBL13792415 0.82 ALOX5 (0.77) ALOX5BCHEACHEALDH1A1POLB
SCHEMBL99747 0.82 HTT (0.48) ALOX5TDP1SMN1; SMN2HTTALDH1A1
SCHEMBL3523678 0.81 L3MBTL1 (0.48) ALOX5L3MBTL1TDP1BCHEACHE
SCHEMBL3988521 0.79 ALOX5 (0.62) ALOX5SMN1; SMN2HTTALDH1A1KDM4E
SCHEMBL20610763 0.77 F2RL1 (0.62) ALOX5L3MBTL1TDP1SMN1; SMN2ALDH1A1
SCHEMBL18936422 0.77 NPC1 (0.44) ALOX5L3MBTL1SMN1; SMN2HTTALDH1A1
SCHEMBL1708481 0.76 HTT (0.56) ALOX5SMN1; SMN2HTTALDH1A1KDM4E
SCHEMBL1008295 0.75 L3MBTL1 (0.62) L3MBTL1TDP1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL12982286 0.75 NPC1 (0.51) TDP1ACHESMN1; SMN2HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240360163-A1 Nucleoside Prodrugs and Uses Related Thereto UNIV EMORY (US) 2024-10-31 US disclosed
US-12049474-B2 Nucleoside prodrugs and uses related thereto EMORY UNIVERSITY (US) 2024-07-30 US disclosed
US-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto UNIV EMORY (US) 2022-09-22 US disclosed
EP-4017499-A1 NUCLEOSIDE PRODRUGS AND USES RELATED THERETO Emory University (US) 2022-06-29 EP disclosed
CN-114502172-A Nucleoside prodrugs and related uses thereof 爱默蕾大学 2022-05-13 CN disclosed
WO-2021035214-A1 NUCLEOSIDE PRODRUGS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2021-02-25 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 (3 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-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto PNPO, GSTO1, CYP2C18 ALOX5 12/4885L3MBTL1 4216/4885TDP1 1205/4885
US-20240360163-A1 Nucleoside Prodrugs and Uses Related Thereto PNPO, GSTO1, CYP2C18 ALOX5 12/4885L3MBTL1 4216/4885TDP1 1205/4885
US-12049474-B2 Nucleoside prodrugs and uses related thereto PNPO, GSTO1, CYP2C18 ALOX5 12/4885L3MBTL1 4216/4885TDP1 1205/4885

“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.