SCHEMBL25345280

SCHEMBL25345280

CN(CCOCCn1nccc1B(O)O)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.34
HTR2C P28335 1/20 0.33
SLC6A4 P31645 1/20 0.33
KAT6A Q92794 1/20 0.33
KAT5 Q92993 1/20 0.33
AAK1 Q2M2I8 1/20 0.32
GBA1 P04062 1/20 0.32
KDM2B Q8NHM5 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CSNK2A1 P68400 1/20 0.30
CCNE2 O96020 1/20 0.30
CCNE1 P24864 1/20 0.30
CDK2 P24941 1/20 0.30

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
SCHEMBL24192200 0.79 CA12 (0.39)
SCHEMBL24192519 0.78 USP30 (0.36) PDK2HTR2CSLC6A4KAT6AKAT5
SCHEMBL30417248 0.73 PDK2 (0.35) PDK2HTR2CSLC6A4AAK1GBA1
SCHEMBL24192262 0.72 PDK2 (0.32) PDK2
SCHEMBL26924422 0.72 PDK2 (0.42) PDK2HTR2CSLC6A4KAT6AKAT5
SCHEMBL25970151 0.72 CYP1A2 (0.38)
SCHEMBL22276510 0.72 PDK2 (0.40) PDK2AAK1GBA1L3MBTL1
SCHEMBL22276649 0.72 PDK2 (0.40) PDK2AAK1GBA1L3MBTL1
SCHEMBL21071663 0.70 PDK2 (0.45) PDK2
SCHEMBL25826908 0.70 KAT6A (0.33) PDK2HTR2CSLC6A4KAT6AKAT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257396-A1 MACROCYCLES AND THEIR USE BLOSSOMHILL THERAPEUTICS INC (US) 2023-08-17 US disclosed
EP-4178958-A1 MACROCYCLES AND THEIR USE Blossomhill Therapeutics, Inc. (US) 2023-05-17 EP 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-20230257396-A1 MACROCYCLES AND THEIR USE VHL, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, DLD PDK2 580/4885HTR2C 705/4885SLC6A4 3651/4885

“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.