SCHEMBL29759792

SCHEMBL29759792

COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 7/20 0.34
▸ JAK2 O60674 4/20 0.34
▸ JAK1 P23458 4/20 0.34
▸ TYK2 P29597 4/20 0.34
▸ JAK3 P52333 3/20 0.34
▸ TAS2R8 Q9NYW2 1/20 0.34
▸ PIM1 P11309 1/20 0.34
▸ IRAK1 P51617 2/20 0.33
▸ NTRK1 P04629 1/20 0.33
▸ POLQ O75417 1/20 0.33
▸ WNT1 P04628 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ GPR6 P46095 1/20 0.33

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
SCHEMBL24577300 1.00 IRAK4 (0.34) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL29759832 0.94 PDCD1 (0.38) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL27185212 0.94 PDCD1 (0.38) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL29760053 0.94 ALDH1A1 (0.37) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL29759640 0.93 IRAK4 (0.35) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL27185052 0.93 PDCD1 (0.38) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL24579123 0.93 IRAK4 (0.35) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL29759897 0.93 PDCD1 (0.38) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL30897455 0.92 WNT1 (0.35) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL27185208 0.92 WNT1 (0.35) IRAK4JAK2JAK1TYK2JAK3

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-20240109917-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2024-04-04 — — US disclosed
EP-4267585-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS Actelion Pharmaceuticals Ltd (CH) 2023-11-01 — — EP disclosed
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 — — WO 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-20240109917-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS PDGFRA, PDGFRB, ABL1 IRAK4 1838/4885JAK2 9/4885JAK1 42/4885

“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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