SCHEMBL25613086

SCHEMBL25613086

CC(C)(C)c1cc2cc[nH]c2nc1OC1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 2/20 0.46
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ CDK1 P06493 1/20 0.38
▸ TTK P33981 2/20 0.37
▸ LRRK2 Q5S007 4/20 0.36
▸ CDK2 P24941 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ FEN1 P39748 3/20 0.34
▸ ROCK1 Q13464 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ALOX5AP P20292 2/20 0.32
▸ ULK1 O75385 1/20 0.32
▸ NPY1R P25929 1/20 0.32
▸ NPY2R P49146 1/20 0.32
▸ HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL25613082 0.99 JAK3 (0.48) JAK3JAK2JAK1CDK1TTK
SCHEMBL25613075 0.97 JAK3 (0.43) JAK3JAK2JAK1CDK1TTK
SCHEMBL25613062 0.94 JAK3 (0.39) JAK3JAK2JAK1CDK1TTK
SCHEMBL25613085 0.90 ROCK1 (0.41) JAK3FEN1ROCK1
SCHEMBL25613083 0.87 LRRK2 (0.40) JAK3JAK1LRRK2LMNAMAPT
SCHEMBL25613079 0.86 FEN1 (0.34) JAK3FEN1ROCK1
SCHEMBL25613060 0.85 TTK (0.38) JAK3TTKLRRK2FEN1
SCHEMBL25613074 0.85 PRKCZ (0.44) ROCK1
SCHEMBL25613078 0.84 PIK3CD (0.33) JAK3FEN1
SCHEMBL25613081 0.84 LRRK2 (0.41) TTKLRRK2

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-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 JAK3 3456/4885JAK2 431/4885JAK1 3603/4885

“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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