SCHEMBL25840836

SCHEMBL25840836

CCCC1CN(C)CCN1C(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.35
POLB P06746 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 3/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
RECQL P46063 1/20 0.31
GAA P10253 2/20 0.30
MAPK1 P28482 2/20 0.30
ALDH1A1 P00352 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL24091521 0.84 PKM (0.31) PKM
SCHEMBL12828284 0.84 PKM (0.31) PKM
SCHEMBL20334362 0.83 PKM (0.50) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL25738599 0.83 PKM (0.35) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL26815280 0.81 PKM (0.35) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL26620069 0.81 PKM (0.35) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL25959369 0.80
SCHEMBL25737735 0.80 NCF1 (0.40) PKM
SCHEMBL16158903 0.78 PKM (0.36) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL16158945 0.78 PKM (0.36) PKMPOLBL3MBTL1LMNAKMT2A

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-11697648-B2 Fused pyrimidine pyridinone compounds as JAK inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-07-11 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-11697648-B2 Fused pyrimidine pyridinone compounds as JAK inhibitors JAK3, JAK1, JAK2 PKM 1003/4885POLB 2819/4885L3MBTL1 4396/4885

“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.