SCHEMBL29305098

SCHEMBL29305098

CSc1nc(Cl)cc(NCc2cn3cc(C4CC4)ccc3n2)n1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.42
▸ KLKB1 P03952 17/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SMN1; SMN2 Q16637 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
SCHEMBL30997819 1.00 METTL3 (0.42) METTL3KLKB1KDM4ETP53MEN1
SCHEMBL30997805 0.84 METTL3 (0.42) METTL3KLKB1KDM4ETP53
SCHEMBL24739081 0.84 METTL3 (0.42) METTL3KLKB1KDM4ETP53
SCHEMBL27033897 0.84 METTL3 (0.45) METTL3KLKB1
SCHEMBL29957586 0.84 METTL3 (0.45) METTL3KLKB1
SCHEMBL30997864 0.83 KLKB1 (0.44) METTL3KLKB1KDM4ETP53
SCHEMBL24739073 0.83 KLKB1 (0.44) METTL3KLKB1KDM4ETP53
SCHEMBL29958341 0.82 METTL3 (0.46) METTL3KLKB1
SCHEMBL29957790 0.82 METTL3 (0.42) METTL3KLKB1KDM4ETP53
SCHEMBL27033530 0.82 METTL3 (0.46) METTL3KLKB1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN TAKEDA PHARMACEUTICALS CO (JP) 2024-07-11 — — 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-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK5, KLK1 METTL3 4596/4885KLKB1 1/4885KDM4E 796/4885

“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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