SCHEMBL29742001

SCHEMBL29742001

Cn1cc(Br)cc(Nc2ccc(C(=O)N3CCOCC3)cn2)c1=O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BTK Q06187 11/20 0.59
CLK2 P49760 1/20 0.56
KDM4E B2RXH2 1/20 0.56
RAB9A P51151 1/20 0.56
SRC P12931 1/20 0.49
HPGD P15428 1/20 0.48
TYK2 P29597 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
JAK3 P52333 1/20 0.47
ALDH1A1 P00352 1/20 0.46
CCNT1 O60563 2/20 0.45
CDK9 P50750 2/20 0.45

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
SCHEMBL709078 1.00 BTK (0.59) BTKCLK2KDM4ERAB9ASRC
SCHEMBL708915 0.90 HPGD (0.50) BTKCLK2HPGDTYK2JAK2
SCHEMBL16014700 0.88 BTK (0.59) BTKCLK2KDM4ERAB9ASRC
SCHEMBL19593978 0.88 BTK (0.61) BTKCLK2KDM4ERAB9ASRC
SCHEMBL14914719 0.85 BTK (0.45) BTKCLK2KDM4ERAB9AHPGD
SCHEMBL29742163 0.85 BTK (0.45) BTKCLK2KDM4ERAB9AHPGD
SCHEMBL14914721 0.85 BTK (0.45) BTKCLK2KDM4ERAB9AHPGD
SCHEMBL14914844 0.85 BTK (0.45) BTKCLK2KDM4ERAB9AHPGD
SCHEMBL700756 0.83 BTK (0.54) BTKCLK2KDM4ERAB9ASRC
SCHEMBL29741954 0.83 BTK (0.54) BTKCLK2KDM4ERAB9ASRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120004902-A Heteroaryl heterocycles and uses thereof 和记黄埔医药(上海)有限公司 2025-05-16 CN disclosed
CN-119930630-A Heteroaryl heterocycles and uses thereof 和记黄埔医药(上海)有限公司 2025-05-06 CN disclosed
CN-119925375-A Heteroaryl heterocycles and uses thereof 和记黄埔医药(上海)有限公司 2025-05-06 CN disclosed
CN-115151535-B Heteroaryl heterocycles and uses thereof 和记黄埔医药(上海)有限公司 2025-01-10 CN disclosed
US-20240270747-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2024-08-15 US disclosed
US-20230279012-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2023-09-07 US disclosed
CN-115151535-A Heteroaryl heterocyclic compounds and uses thereof 和记黄埔医药(上海)有限公司 2022-10-04 CN disclosed
EP-4050012-A1 PYRIDONE BORONATES FOR THE PREPARATION OF INHIBITORS OF BTK ACTIVITY F. Hoffmann-La Roche AG (CH) 2022-08-31 EP disclosed
EP-4019508-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY F. Hoffmann-La Roche AG (CH) 2022-06-29 EP 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-20240270747-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS PDXK, BTK, TYK2 BTK 2/4885CLK2 173/4885KDM4E 1352/4885
US-20230279012-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS PDXK, BTK, TYK2 BTK 2/4885CLK2 173/4885KDM4E 1352/4885

“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.