SCHEMBL25613101

SCHEMBL25613101

CC(C)(C)c1cc2cc[nH]c2nc1OCC1CCN1S(C)(=O)=O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 12/20 0.34
▸ JAK3 P52333 10/20 0.34
▸ ATR Q13535 1/20 0.32
▸ JAK1 P23458 9/20 0.32
▸ CHRNA7 P36544 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ CASP3 P42574 2/20 0.31
▸ CASP7 P55210 2/20 0.31
▸ BRD4 O60885 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
SCHEMBL25613110 0.94 JAK2 (0.38) JAK2JAK3JAK1CASP3CASP7
SCHEMBL25613103 0.84 CHRNA3 (0.42) —
SCHEMBL25627063 0.84 — —
SCHEMBL25613102 0.82 FEN1 (0.31) JAK1
SCHEMBL25613114 0.80 CHRNB4 (0.46) —
SCHEMBL25613112 0.78 TDP1 (0.35) —
SCHEMBL25613092 0.77 CDK2 (0.40) —
SCHEMBL25613094 0.77 CDK2 (0.38) —
SCHEMBL25613097 0.76 CHRNB4 (0.39) —
SCHEMBL25613037 0.72 FEN1 (0.39) PIK3CABRD4

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-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON BIOSCIENCES, LTD. (CN) 2023-05-25 — — US disclosed
US-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON BIOSCIENCES, LTD. (CN) 2023-05-25 — — 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-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS BCL2, BCL2L2, BCL2L1 JAK2 431/4885JAK3 3456/4885ATR 2069/4885

“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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