SCHEMBL29540543

SCHEMBL29540543

CCOC(=O)C(CN)Cn1cc(-c2ccnc3[nH]ccc23)cn1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 2/20 0.51
INCENP Q9NQS7 2/20 0.51
AURKA O14965 1/20 0.51
TPX2 Q9ULW0 1/20 0.51
CIT O14578 9/20 0.49
GRM4 Q14833 1/20 0.47
NUDT1 P36639 1/20 0.46
IKBKB O14920 1/20 0.43
CHUK O15111 1/20 0.43
JAK2 O60674 3/20 0.43
JAK1 P23458 3/20 0.43
TYK2 P29597 1/20 0.43
JAK3 P52333 1/20 0.43
NEK1 Q96PY6 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
SCHEMBL100699 1.00 AURKB (0.51) AURKBINCENPAURKATPX2CIT
SCHEMBL99923 0.80 AURKA (0.55) AURKBINCENPAURKATPX2CIT
SCHEMBL27762512 0.77 GRM4 (0.55) AURKBINCENPAURKATPX2CIT
SCHEMBL103386 0.77 AURKB (0.58) AURKBINCENPAURKATPX2CIT
SCHEMBL98741 0.76 AURKA (0.55) AURKBINCENPAURKATPX2CIT
SCHEMBL100615 0.76 GRM4 (0.62) AURKBINCENPAURKATPX2CIT
SCHEMBL19062551 0.76 AURKA (0.52) AURKBINCENPAURKATPX2CIT
SCHEMBL20879725 0.76 AURKB (0.70) AURKBINCENPAURKATPX2CIT
SCHEMBL99733 0.74 AURKA (0.58) AURKBINCENPAURKATPX2CIT
SCHEMBL29540844 0.74 AURKA (0.58) AURKBINCENPAURKATPX2CIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11744832-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors INCYTE CORPORATION (US) 2023-09-05 US disclosed
US-20220395506-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION 2022-12-15 US disclosed
US-11331320-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2022-05-17 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 (3 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-20220395506-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS JAK3, JAK1, JAK2 AURKB 198/4885INCENP 4449/4885AURKA 485/4885
US-11744832-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors JAK3, JAK1, JAK2 AURKB 198/4885INCENP 4449/4885AURKA 485/4885
US-11331320-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors JAK3, JAK1, JAK2 AURKB 198/4885INCENP 4449/4885AURKA 485/4885

“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.