SCHEMBL31617994

SCHEMBL31617994

CNC(=O)[C@H]1C[C@@H](n2cc(Br)c3c(Cl)ncnc32)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 8/20 0.44
▸ METTL3 Q86U44 6/20 0.34
▸ ADORA3 P0DMS8 2/20 0.32
▸ RAPGEF3 O95398 1/20 0.31
▸ PRMT5 O14744 1/20 0.31
▸ WDR77 Q9BQA1 1/20 0.31

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
SCHEMBL25046663 0.89 ADK (0.46) ADKMETTL3RAPGEF3
SCHEMBL31618062 0.89 ADK (0.44) ADKMETTL3RAPGEF3PRMT5
SCHEMBL31617998 0.86 ADK (0.44) ADKMETTL3RAPGEF3
SCHEMBL20488512 0.81 ADK (0.43) ADKMETTL3RAPGEF3
SCHEMBL30941168 0.81 ADK (0.46) ADKMETTL3
SCHEMBL29610855 0.80 ADK (0.43) ADKMETTL3PRMT5WDR77
SCHEMBL24314271 0.80 ADK (0.43) ADKMETTL3PRMT5WDR77
SCHEMBL24314267 0.79 ADK (0.43) ADKMETTL3
SCHEMBL20488584 0.79 PRMT5 (0.45) ADKMETTL3PRMT5WDR77
SCHEMBL25047932 0.78 ADK (0.43) ADKPRMT5WDR77

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-20250188110-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2025-06-12 — — 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-20250188110-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION KMT5A, KMT5B, KMT5C ADK 1700/4885METTL3 166/4885ADORA3 1416/4885

“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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