SCHEMBL24671781

SCHEMBL24671781

CC(C)(C)OC(=O)C1CN(C2CCN(c3ccc(N)cn3)CC2)C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ABL1 P00519 1/20 0.41
LMNA P02545 1/20 0.41
GPR119 Q8TDV5 3/20 0.41
HDAC1 Q13547 2/20 0.41
HRH3 Q9Y5N1 8/20 0.40
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
ADRA1A P35348 4/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38

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
SCHEMBL13009560 0.90 KDM4E (0.48) KDM4EABL1LMNAGPR119CKS1B
SCHEMBL31055510 0.83 MAPT (0.57) KDM4ELMNA
SCHEMBL30801243 0.82 LMNA (0.44) KDM4EABL1LMNAHRH3ADRA1A
SCHEMBL530038 0.78 CKS1B (0.61) GPR119HRH3CKS1BSKP1SKP2
SCHEMBL31329736 0.77 GPR119 (0.68) GPR119DDB1CRBN
SCHEMBL23783219 0.77 GPR119 (0.68) GPR119DDB1CRBN
SCHEMBL529863 0.76 MAP4K4 (0.58) CKS1BSKP1SKP2
SCHEMBL594137 0.76 MAP4K4 (0.58) CKS1BSKP1SKP2
SCHEMBL595584 0.76 AAK1 (0.47) KDM4EABL1LMNAGPR119CKS1B
SCHEMBL27940103 0.76 HDAC1 (0.42) KDM4EABL1LMNAGPR119HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240279202-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. 2024-08-22 US disclosed
CN-117693502-A Compounds for inhibiting or degrading ITK, compositions comprising the same, methods of making the same, and methods of using the same 纽力克斯治疗公司 2024-03-12 CN disclosed
WO-2022235715-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. (US) 2022-11-10 WO 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-20240279202-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE ITK, NFATC1, TNIK KDM4E 1873/4885ABL1 888/4885LMNA 2875/4885

“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.