SCHEMBL31578997

SCHEMBL31578997

CC(C)(C)OC(=O)N1CCC2(CC1)CN(c1ncnc3cc(F)c(C=O)cc13)C2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 2/20 0.42
▸ HDAC2 Q92769 2/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ PARP1 P09874 5/20 0.40
▸ MAP4K4 O95819 1/20 0.39
▸ GPR119 Q8TDV5 2/20 0.39
▸ TNKS O95271 3/20 0.38
▸ TNKS2 Q9H2K2 3/20 0.38
▸ CYP11B2 P19099 1/20 0.38
▸ ACACB O00763 1/20 0.38
▸ SCD5 Q86SK9 1/20 0.37
▸ JAK3 P52333 2/20 0.37
▸ RET P07949 1/20 0.37
▸ ACHE P22303 1/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ PDGFRB P09619 1/20 0.36

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
SCHEMBL31578988 0.92 KIT (0.42) KITHDAC2HDAC1PARP1MAP4K4
SCHEMBL31578981 0.87 KIT (0.44) KITHDAC2HDAC1PARP1MAP4K4
SCHEMBL30406325 0.84 KIT (0.41) KITHDAC2HDAC1PARP1GPR119
SCHEMBL31578990 0.83 MAP4K4 (0.42) KITHDAC2HDAC1PARP1MAP4K4
SCHEMBL25422069 0.81 HTT (0.49) KITHDAC2HDAC1MAP4K4GPR119
SCHEMBL30405762 0.81 HTT (0.49) KITHDAC2HDAC1MAP4K4GPR119
SCHEMBL30405719 0.80 MAPK7 (0.47) KITHDAC2HDAC1MAP4K4GPR119
SCHEMBL25232266 0.80 MAPK7 (0.47) KITHDAC2HDAC1MAP4K4GPR119
SCHEMBL25280892 0.79 KIT (0.44) KITHDAC2HDAC1PARP1MAP4K4
SCHEMBL30405237 0.79 KIT (0.44) KITHDAC2HDAC1PARP1MAP4K4

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-20250163061-A1 INHIBITORS OF MENIN-MLL INTERACTION BALA THERAPEUTICS, INC. 2025-05-22 — — 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-20250163061-A1 INHIBITORS OF MENIN-MLL INTERACTION MLLT1, MEN1, BMI1 KIT 1067/4885HDAC2 241/4885HDAC1 158/4885

“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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