SCHEMBL23748174

SCHEMBL23748174

COc1cc(F)c(F)c(C)c1C(=O)OCC(C)(C)[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.39
L3MBTL1 Q9Y468 2/20 0.34
PRKCZ Q05513 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
LMNA P02545 2/20 0.32
CYP2C19 P33261 1/20 0.32
CYP3A4 P08684 1/20 0.31
HTT P42858 1/20 0.31
USP2 O75604 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL23748272 0.80 PRKCZ (0.46) ALDH1A1L3MBTL1PRKCZLMNACYP3A4
SCHEMBL1095401 0.80 ALDH1A1 (0.39) ALDH1A1L3MBTL1CYP2C19CYP3A4
SCHEMBL421953 0.73 ALDH1A1 (0.35) ALDH1A1LMNACYP3A4
SCHEMBL9282939 0.71 LMNA (0.46) ALDH1A1L3MBTL1LMNACYP3A4HTT
SCHEMBL9283161 0.68 NSD2 (0.41) ALDH1A1L3MBTL1LMNACYP2C19HTT
SCHEMBL23748207 0.68 PRKCZ (0.43) ALDH1A1L3MBTL1PRKCZLMNACYP3A4
SCHEMBL3067123 0.65 PRKCZ (0.45) ALDH1A1L3MBTL1PRKCZLMNACYP3A4
SCHEMBL11909148 0.64 PKM (0.42) ALDH1A1L3MBTL1CYP3A4HTTMAPT
SCHEMBL30865056 0.64 PKM (0.42) ALDH1A1L3MBTL1CYP3A4HTTMAPT
SCHEMBL30865055 0.64 PKM (0.42) ALDH1A1L3MBTL1CYP3A4HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002409-A1 MACROCYCLIC FLU ENDONUCLEASE INHIBITORS JANSSEN BIOPHARMA INC (US) 2023-01-05 US disclosed
US-11312727-B1 Macrocyclic flu endonuclease inhibitors Janssen Biopharma, Inc. (US) 2022-04-26 US disclosed
EP-3864020-A1 MACROCYCLIC FLU ENDONUCLEASE INHIBITORS Janssen BioPharma, Inc. (US) 2021-08-18 EP disclosed
CN-113195502-A Macrocyclic influenza endonuclease inhibitors 詹森生物制药有限公司 2021-07-30 CN 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-20230002409-A1 MACROCYCLIC FLU ENDONUCLEASE INHIBITORS ACE, PNP, FEN1 ALDH1A1 2073/4885L3MBTL1 2124/4885PRKCZ 1812/4885
US-11312727-B1 Macrocyclic flu endonuclease inhibitors ACE, FEN1, PNP ALDH1A1 1487/4885L3MBTL1 3042/4885PRKCZ 2236/4885

“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.