SCHEMBL23748294

SCHEMBL23748294

CCOC(=O)c1c(O)cc(F)c(F)c1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.59
NR1H3 Q13133 1/20 0.59
CYP3A4 P08684 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
CA12 O43570 5/20 0.51
CA1 P00915 5/20 0.51
CA2 P00918 5/20 0.51
CA7 P43166 5/20 0.51
CA9 Q16790 5/20 0.51
CA14 Q9ULX7 5/20 0.51
HPGD P15428 3/20 0.50
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.44
ATM Q13315 1/20 0.43
NPC1 O15118 2/20 0.42
KMT2A Q03164 2/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42

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 0.81 PRKCZ (0.46) NR1H2NR1H3CYP3A4SMN1; SMN2CA12
SCHEMBL1999399 0.80 NR1H2 (0.53) NR1H2NR1H3CYP3A4SMN1; SMN2TDP1
SCHEMBL31643756 0.79 NR1H2 (0.67) NR1H2NR1H3CYP3A4SMN1; SMN2TDP1
SCHEMBL1999063 0.79 NR1H2 (0.52) NR1H2NR1H3CYP3A4SMN1; SMN2TDP1
SCHEMBL18774743 0.78 HPGD (0.55) NR1H2NR1H3CYP3A4SMN1; SMN2TDP1
SCHEMBL2184188 0.76 TSHR (0.48) TDP1CA12CA1CA2CA7
SCHEMBL23484390 0.75 NR1H2 (0.67) NR1H2NR1H3CYP3A4SMN1; SMN2TDP1
SCHEMBL5364253 0.75 CA12 (0.58) NR1H2NR1H3CA12CA1CA2
SCHEMBL11315535 0.74 NR1H2 (0.71) NR1H2NR1H3CYP3A4SMN1; SMN2TDP1
SCHEMBL9751189 0.74 NR1H2 (0.78) NR1H2NR1H3CYP3A4SMN1; SMN2TDP1

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
US-20230002409-A1 MACROCYCLIC FLU ENDONUCLEASE INHIBITORS JANSSEN BIOPHARMA INC (US) 2023-01-05 US disclosed
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
US-11312727-B1 Macrocyclic flu endonuclease inhibitors Janssen Biopharma, Inc. (US) 2022-04-26 US disclosed
CN-114057769-A Macrocyclic pyridazine compound and application thereof 上海拓界生物医药科技有限公司 2022-02-18 CN 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 NR1H2 2561/4885NR1H3 2633/4885CYP3A4 88/4885
US-11312727-B1 Macrocyclic flu endonuclease inhibitors ACE, FEN1, PNP NR1H2 1922/4885NR1H3 2051/4885CYP3A4 88/4885

“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.