SCHEMBL29958986

SCHEMBL29958986

COc1ccc(F)cc1-n1nc(C)c2cnc(-c3cnn4cccnc34)cc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 1/20 0.41
▸ JAK2 O60674 4/20 0.39
▸ SLC2A1 P11166 2/20 0.38
▸ SLC2A3 P11169 2/20 0.38
▸ SLC2A2 P11168 1/20 0.38
▸ IRAK4 Q9NWZ3 11/20 0.37
▸ JAK1 P23458 3/20 0.37
▸ TYK2 P29597 3/20 0.37
▸ JAK3 P52333 3/20 0.37
▸ GAA P10253 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ BMP4 P12644 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
SCHEMBL27028672 1.00 PLK1 (0.41) PLK1JAK2SLC2A1SLC2A3SLC2A2
SCHEMBL27028684 0.91 IRAK4 (0.42) PLK1JAK2IRAK4JAK1TYK2
SCHEMBL29958736 0.89 IRAK4 (0.44) PLK1JAK2IRAK4JAK1TYK2
SCHEMBL27028607 0.89 IRAK4 (0.44) PLK1JAK2IRAK4JAK1TYK2
SCHEMBL27028664 0.89 PLK1 (0.37) PLK1JAK2IRAK4JAK1TYK2
SCHEMBL27028582 0.89 PLK1 (0.43) PLK1JAK2IRAK4JAK1TYK2
SCHEMBL29958655 0.89 PLK1 (0.43) PLK1JAK2IRAK4JAK1TYK2
SCHEMBL27028655 0.86 IRAK4 (0.35) PLK1JAK2IRAK4JAK1TYK2
SCHEMBL29958609 0.85 IRAK4 (0.37) PLK1JAK2IRAK4JAK1TYK2
SCHEMBL27028705 0.85 IRAK4 (0.37) PLK1JAK2IRAK4JAK1TYK2

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 5 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
US-20240279240-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-08-22 — — 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 (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 781/4885JAK2 4/4885SLC2A1 4848/4885

“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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