SCHEMBL30133781

SCHEMBL30133781

CC(O)c1ccc(F)cc1C(C)(F)F

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.42
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CES2 O00748 2/20 0.34
CES1 P23141 2/20 0.34
KCNH2 Q12809 3/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
DPP4 P27487 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
IDO1 P14902 2/20 0.32
LIPG Q9Y5X9 1/20 0.32
NR3C2 P08235 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 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
SCHEMBL30134232 0.87 PDE2A (0.47) PDE2AMEN1KMT2ACES2CES1
SCHEMBL3736531 0.87 PDE2A (0.47) PDE2AMEN1KMT2ACES2CES1
SCHEMBL15933090 0.85 PDE2A (0.39) PDE2AMEN1KMT2ACES2CES1
SCHEMBL23195508 0.85 NOTUM (0.34) PDE2AKCNH2DPP4SLC6A2SLC6A4
SCHEMBL16044673 0.81 PDE2A (0.40) PDE2AHTR2AHTR2CDPP4IDO1
SCHEMBL15853708 0.74 CES2 (0.52) PDE2AMEN1KMT2ACES2CES1
SCHEMBL29453648 0.74 CES2 (0.52) PDE2AMEN1KMT2ACES2CES1
SCHEMBL1998132 0.74 CES2 (0.52) PDE2AMEN1KMT2ACES2CES1
SCHEMBL17947416 0.74 CES2 (0.52) PDE2AMEN1KMT2ACES2CES1
SCHEMBL31085192 0.74 PDE2A (0.39) PDE2AMEN1KMT2ACES2CES1

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
CN-119119033-A Pyrazolopyridone compounds 百济神州有限公司 2024-12-13 CN disclosed
US-20240300951-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-09-12 US disclosed
US-20240270751-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-08-15 US disclosed
EP-4380936-A1 PYRAZOLOPYRIDINONE COMPOUNDS BeiGene, Ltd. (KY) 2024-06-12 EP disclosed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN disclosed
WO-2023011456-A1 PYRAZOLOPYRIDINONE COMPOUNDS BEIGENE, LTD. (KY) 2023-02-09 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-20240300951-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK PDE2A 986/4885MEN1 3837/4885KMT2A 2627/4885
US-20240270751-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK PDE2A 986/4885MEN1 3837/4885KMT2A 2627/4885

“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.