SCHEMBL23828193

SCHEMBL23828193

CN1C(=O)C(Cc2ccccn2)N(C2CCCC2)c2nc(Nc3ccc4[nH]nnc4c3)ncc21

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK7 Q13164 2/20 0.55
▸ PLK1 P53350 15/20 0.52
▸ PLK3 Q9H4B4 11/20 0.52
▸ PLK2 Q9NYY3 11/20 0.52
▸ BRD4 O60885 6/20 0.51
▸ PIP4K2A P48426 1/20 0.49
▸ PIP4K2B P78356 1/20 0.49
▸ PARP1 P09874 2/20 0.48
▸ TAF1 P21675 1/20 0.47
▸ DYRK1A Q13627 1/20 0.46
▸ ALK Q9UM73 1/20 0.43

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
SCHEMBL23828190 1.00 MAPK7 (0.55) MAPK7PLK1PLK3PLK2BRD4
SCHEMBL23828183 0.87 PIP4K2A (0.64) MAPK7PLK1PLK3PLK2BRD4
SCHEMBL23828184 0.87 PIP4K2A (0.64) MAPK7PLK1PLK3PLK2BRD4
SCHEMBL23828192 0.81 PIP4K2A (0.74) MAPK7PLK1PLK3PLK2BRD4
SCHEMBL23828191 0.81 PIP4K2A (0.74) MAPK7PLK1PLK3PLK2BRD4
SCHEMBL23849050 0.76 PLK1 (0.51) PLK1PLK3PLK2BRD4PIP4K2A
SCHEMBL21683215 0.75 PLK1 (0.50) PLK1PLK3PLK2BRD4PIP4K2A
SCHEMBL21683218 0.75 PLK1 (0.50) PLK1PLK3PLK2BRD4PIP4K2A
SCHEMBL13551775 0.74 PLK1 (0.82) PLK1PLK3PLK2BRD4PARP1
SCHEMBL27369473 0.74 PLK1 (0.82) PLK1PLK3PLK2BRD4PARP1

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-11773096-B2 Small-molecule PI5P4K alpha/beta inhibitors and methods of treatment using same YALE UNIVERSITY (US) 2023-10-03 — — US claimed
US-11773096-B2 Small-molecule PI5P4K alpha/beta inhibitors and methods of treatment using same YALE UNIVERSITY (US) 2023-10-03 — — US disclosed
US-20210292326-A1 Small-Molecule PI5P4K alpha/beta Inhibitors and Methods of Treatment Using Same UNIV YALE (US) 2021-09-23 — — 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 (2 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-11773096-B2 Small-molecule PI5P4K alpha/beta inhibitors and methods of treatment using same PI4KB, TP53, PI4K2B MAPK7 1478/4885PLK1 140/4885PLK3 82/4885
US-20210292326-A1 Small-Molecule PI5P4K alpha/beta Inhibitors and Methods of Treatment Using Same PI4KB, TP53, PI4K2B MAPK7 1478/4885PLK1 140/4885PLK3 82/4885

“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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