SCHEMBL30940800

SCHEMBL30940800

CC(C)(C)OC(=O)NCc1cccc([C@H]2C[C@@H](n3ccc4c(N)nc(Cl)nc43)[C@@H]3OC(C)(C)O[C@@H]32)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CHKA P35790 1/20 0.36
▸ NT5E P21589 3/20 0.36
▸ BRD4 O60885 3/20 0.35
▸ TARS1 P26639 1/20 0.34
▸ CYP2D6 P10635 1/20 0.33
▸ ROCK2 O75116 1/20 0.33
▸ CREBBP Q92793 1/20 0.33
▸ ACACB O00763 2/20 0.32
▸ ACACA Q13085 2/20 0.32
▸ GLS O94925 2/20 0.32
▸ MAPKAPK2 P49137 1/20 0.32
▸ NAMPT P43490 3/20 0.31
▸ CCKBR P32239 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 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
SCHEMBL30941254 0.94 BRD4 (0.36) CHKABRD4CYP2D6ROCK2CREBBP
SCHEMBL25047831 0.88 METTL3 (0.41) CHKABRD4CYP2D6ROCK2CREBBP
SCHEMBL30941032 0.86 PRMT5 (0.40) BRD4CYP2D6ROCK2CREBBPGLS
SCHEMBL25047726 0.84 PRMT5 (0.36) NT5E
SCHEMBL25046572 0.84 METTL3 (0.37) CHKABRD4CYP2D6ROCK2CREBBP
SCHEMBL30941558 0.83 CHKA (0.32) CHKAROCK2ACACBACACA
SCHEMBL25048316 0.82 HTR2C (0.34) GLS
SCHEMBL30941316 0.81 PRMT5 (0.38) BRD4CYP3A4
SCHEMBL30941531 0.79 CCNE2 (0.35) BRD4ROCK2
SCHEMBL30941297 0.78 AURKA (0.38) BRD4

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 CHKA 807/4885NT5E 2836/4885BRD4 131/4885

“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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