SCHEMBL29958641

SCHEMBL29958641

COc1cc(O)ccc1-n1nc(C)c2cnc(-c3cnn4cccnc34)cc21

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 1/20 0.39
▸ IRAK4 Q9NWZ3 14/20 0.37
▸ JAK2 O60674 2/20 0.35
▸ JAK1 P23458 2/20 0.35
▸ TYK2 P29597 2/20 0.35
▸ JAK3 P52333 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ BMP4 P12644 1/20 0.34
▸ IRAK1 P51617 1/20 0.34

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
SCHEMBL27028713 1.00 PLK1 (0.39) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL29829699 0.90 IRAK4 (0.47) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL27030968 0.90 IRAK4 (0.47) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL27031007 0.89 PLK1 (0.39) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL29829062 0.89 PLK1 (0.39) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL29958609 0.88 IRAK4 (0.37) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL27028705 0.88 IRAK4 (0.37) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL29162240 0.88 PLK1 (0.40) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL29829344 0.88 PLK1 (0.38) PLK1IRAK4JAK2JAK1TYK2
SCHEMBL27030754 0.88 PLK1 (0.38) PLK1IRAK4JAK2JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240279240-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-08-22 — — US claimed
EP-4308122-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2024-01-24 — — EP claimed
CN-116981459-A Heterocyclic derivatives as janus kinase inhibitors 奇斯药制品公司 2023-10-31 — — CN claimed
WO-2022194779-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2022-09-22 — — WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20240279240-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS TYK2, JAK3, JAK1 PLK1 781/4885IRAK4 9/4885JAK2 4/4885

“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