SCHEMBL29388136

SCHEMBL29388136

C=CC(=O)Nc1cccc(Cn2ncc3cnc(Nc4ccc(F)cc4)nc32)c1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 12/20 0.68
▸ EGFR P00533 8/20 0.59
▸ ITK Q08881 3/20 0.59
▸ JAK2 O60674 3/20 0.54
▸ JAK1 P23458 2/20 0.54
▸ TYK2 P29597 1/20 0.54
▸ BTK Q06187 1/20 0.54
▸ FLT3 P36888 3/20 0.50
▸ BLK P51451 2/20 0.50

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
SCHEMBL21846824 1.00 JAK3 (0.68) JAK3EGFRITKJAK2JAK1
SCHEMBL21846822 0.93 JAK3 (0.72) JAK3EGFRITKJAK2JAK1
SCHEMBL21846879 0.90 JAK3 (0.55) JAK3EGFRITKJAK2BTK
SCHEMBL29387364 0.90 JAK3 (0.55) JAK3EGFRITKJAK2BTK
SCHEMBL21846873 0.90 JAK3 (0.58) JAK3EGFRITKJAK2JAK1
SCHEMBL29385619 0.90 JAK3 (0.58) JAK3EGFRITKJAK2JAK1
SCHEMBL14812608 0.86 JAK3 (0.78) JAK3EGFRJAK2JAK1TYK2
SCHEMBL21846825 0.86 JAK3 (0.68) JAK3EGFRJAK2JAK1TYK2
SCHEMBL29388306 0.86 JAK3 (0.68) JAK3EGFRJAK2JAK1TYK2
SCHEMBL21846862 0.85 JAK3 (0.78) JAK3EGFRJAK2JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11993603-B2 Preparation for 6-amino-1H-pyrazolo[3,4-d]pyrimidine-based JAK kinase inhibitor and application thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES & PEKING UNION MEDICAL COLLEGE (CN) 2024-05-28 — — US disclosed
US-20220048914-A1 PREPARATION FOR 6-AMINO-1H-PYRAZOLO[3,4-D]PYRIMIDINE-BASED JAK KINASE INHIBITOR AND APPLICATION THEREOF CHINA PHARMACEUTICAL UNIVERSITY (CN) 2022-02-17 — — US 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-20220048914-A1 PREPARATION FOR 6-AMINO-1H-PYRAZOLO[3,4-D]PYRIMIDINE-BASED JAK KINASE INHIBITOR AND APPLICATION THEREOF JAK1, JAK3, SSB JAK3 2/4885EGFR 2648/4885ITK 255/4885
US-11993603-B2 Preparation for 6-amino-1H-pyrazolo[3,4-d]pyrimidine-based JAK kinase inhibitor and application thereof JAK1, JAK3, SSB JAK3 2/4885EGFR 2648/4885ITK 255/4885

“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.

Send feedback