SCHEMBL26916630

SCHEMBL26916630

C[C@@H](Oc1cc(B2OC(C)(C)C(C)(C)O2)cnc1N)c1cccnc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.42
▸ PDGFRB P09619 7/20 0.39
▸ KDR P35968 7/20 0.39
▸ AAK1 Q2M2I8 1/20 0.37
▸ F2 P00734 1/20 0.35
▸ F10 P00742 1/20 0.35
▸ F11 P03951 1/20 0.35
▸ CGAS Q8N884 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HDAC5 Q9UQL6 1/20 0.34
▸ CYP17A1 P05093 2/20 0.33
▸ CYP19A1 P11511 2/20 0.33
▸ MAP3K12 Q12852 1/20 0.33
▸ ALPL P05186 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
SCHEMBL26917195 1.00 JAK2 (0.42) JAK2PDGFRBKDRAAK1F2
SCHEMBL29857806 1.00 JAK2 (0.42) JAK2PDGFRBKDRAAK1F2
SCHEMBL26916637 1.00 JAK2 (0.42) JAK2PDGFRBKDRAAK1F2
SCHEMBL29857513 1.00 JAK2 (0.42) JAK2PDGFRBKDRAAK1F2
SCHEMBL10215045 0.90 PDGFRB (0.46) JAK2PDGFRBKDRAAK1MAP3K12
SCHEMBL29857648 0.90 PDGFRB (0.46) JAK2PDGFRBKDRAAK1MAP3K12
SCHEMBL26916323 0.90 PDGFRB (0.46) JAK2PDGFRBKDRAAK1MAP3K12
SCHEMBL26916629 0.90 PDGFRB (0.46) JAK2PDGFRBKDRAAK1MAP3K12
SCHEMBL29857797 0.90 PDGFRB (0.46) JAK2PDGFRBKDRAAK1MAP3K12
SCHEMBL26916586 0.89 PDGFRB (0.39) JAK2PDGFRBKDRAAK1MAP3K12

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-20240174683-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2024-05-30 — — US disclosed
EP-4288437-A1 MAP4K1 INHIBITORS Bayer Aktiengesellschaft (DE) 2023-12-13 — — EP disclosed
WO-2022167627-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2022-08-11 — — 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-20240174683-A1 MAP4K1 INHIBITORS MAP3K4, MAP4K4, MAP4K1 JAK2 1572/4885PDGFRB 2462/4885KDR 972/4885

“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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