SCHEMBL30554118

SCHEMBL30554118

Cc1cc(C[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H](C)CN2C(=O)OCc2ccccc2)ccn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.45
▸ PDK1 Q15118 1/20 0.44
▸ PDK2 Q15119 1/20 0.44
▸ PDK3 Q15120 1/20 0.44
▸ PDK4 Q16654 1/20 0.44
▸ GPR119 Q8TDV5 3/20 0.42
▸ NR1H2 P55055 2/20 0.42
▸ NR1H3 Q13133 2/20 0.42
▸ DPP4 P27487 1/20 0.41
▸ HDAC1 Q13547 2/20 0.41
▸ HTR2C P28335 1/20 0.39
▸ ABCB1 P08183 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ AGTR2 P50052 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL30554121 1.00 PARP1 (0.45) PARP1PDK1PDK2PDK3PDK4
SCHEMBL13323340 0.82 PARP1 (0.54) PARP1PDK1PDK2PDK3PDK4
SCHEMBL24203588 0.82 GPR119 (0.44) PARP1PDK1PDK2PDK3PDK4
SCHEMBL30554127 0.82 GPR119 (0.44) PARP1PDK1PDK2PDK3PDK4
SCHEMBL30554126 0.82 GPR119 (0.44) PARP1PDK1PDK2PDK3PDK4
SCHEMBL22079372 0.82 GPR119 (0.44) PARP1PDK1PDK2PDK3PDK4
SCHEMBL19959357 0.81 PDK1 (0.52) PARP1PDK1PDK2PDK3PDK4
SCHEMBL19959355 0.81 PDK1 (0.52) PARP1PDK1PDK2PDK3PDK4
SCHEMBL29995021 0.81 PDK1 (0.52) PARP1PDK1PDK2PDK3PDK4
SCHEMBL30554120 0.81 PDK1 (0.52) PARP1PDK1PDK2PDK3PDK4

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-12319679-B2 Morpholinyl, piperazinyl, oxazepanyl and diazepanyl O-glycoprotein-2-acetamido-2-deoxy-3-d-glucopyranosidase inhibitors BIOGEN MA INC. (US) 2025-06-03 — — US disclosed
EP-4327814-A2 MORPHOLINYL, PIPERAZINYL, OXAZEPANYL AND DIAZEPANYL O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS Biogen MA Inc. (US) 2024-02-28 — — EP disclosed
EP-3891146-B1 MORPHOLINYL, PIPERAZINYL, OXAZEPANYL AND DIAZEPANYL DERIVATIVES USEFUL AS O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS BIOGEN MA INC (US) 2023-09-27 — — EP 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-12319679-B2 Morpholinyl, piperazinyl, oxazepanyl and diazepanyl O-glycoprotein-2-acetamido-2-deoxy-3-d-glucopyranosidase inhibitors MAN2A1, MAN2B2, MGAT3 PARP1 3527/4885PDK1 1670/4885PDK2 1099/4885

“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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