SCHEMBL31617898

SCHEMBL31617898

CC(C)(C)OC(=O)N(CCCNC[C@H]1C[C@@H](n2cc(-c3nc(Cc4ccccc4)cs3)c3c(N)nc(Cl)nc32)[C@H](O)[C@@H]1O)CCc1ccc(F)cc1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.31
▸ ACKR3 P25106 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
SCHEMBL31617897 1.00 CA2 (0.31) CA2ACKR3
SCHEMBL31617985 0.91 CA2 (0.31) CA2
SCHEMBL25048380 0.89 ACKR3 (0.31) ACKR3
SCHEMBL31618030 0.87 CA2 (0.34) CA2
SCHEMBL25048295 0.86 PRMT5 (0.33) CA2
SCHEMBL31617889 0.85 METTL3 (0.37) —
SCHEMBL25048580 0.84 PRMT5 (0.32) CA2
SCHEMBL25048805 0.83 CA2 (0.35) CA2
SCHEMBL30941400 0.83 CA2 (0.31) CA2
Hydrochloric Acid SCHEMBL30940743 0.83 CA2 (0.34) CA2

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 CA2 3376/4885ACKR3 2202/4885

“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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