SCHEMBL30134297

SCHEMBL30134297

CC(F)(F)c1cnc2ccc(Br)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.44
▸ HDAC4 P56524 1/20 0.36
▸ HTT P42858 3/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ PABPC1 P11940 1/20 0.35
▸ PTGES O14684 3/20 0.34
▸ PIK3R1 P27986 1/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ PPARA Q07869 2/20 0.34
▸ BACE1 P56817 2/20 0.33
▸ ALPL P05186 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ SLC22A12 Q96S37 1/20 0.32

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
SCHEMBL30134165 0.86 NT5E (0.54) NT5EHDAC4HTTCYP1A2CYP2C19
SCHEMBL20364201 0.86 NT5E (0.54) NT5EHDAC4HTTCYP1A2CYP2C19
SCHEMBL14243188 0.80 ESR2 (0.40) HDAC4ALDH1A1MAPT
SCHEMBL29397543 0.79 NT5E (0.54) NT5EHDAC4HTTCYP1A2CYP2C19
SCHEMBL16112819 0.79 NT5E (0.54) NT5EHDAC4HTTCYP1A2CYP2C19
SCHEMBL13208485 0.79 PABPC1 (0.41) NT5EHTTCYP1A2CYP2C19PABPC1
SCHEMBL18661272 0.77 PDE10A (0.44) HTTCYP1A2ALDH1A1MAPT
SCHEMBL30134306 0.75 HDAC4 (0.41) HDAC4HTTPIK3CAALDH1A1MAPT
SCHEMBL30133809 0.75 UGT2B7 (0.37) HDAC4CYP2C19
SCHEMBL21061453 0.73 CYP1A2 (0.43) NT5EHTTCYP1A2CYP2C19PABPC1

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 NT5E 2467/4885HDAC4 691/4885HTT 4803/4885
US-20240270751-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK NT5E 2467/4885HDAC4 691/4885HTT 4803/4885

“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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