SCHEMBL3961208

SCHEMBL3961208

COCC1CCCN1c1ncnc2[nH]ccc12

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 11/20 0.66
▸ JAK1 P23458 3/20 0.55
▸ LCK P06239 1/20 0.52
▸ DOT1L Q8TEK3 2/20 0.52
▸ AKT2 P31751 2/20 0.51
▸ GSK3B P49841 2/20 0.51
▸ JAK2 O60674 1/20 0.51
▸ SCN9A Q15858 1/20 0.50
▸ KIT P10721 1/20 0.50
▸ FFAR2 O15552 1/20 0.48
▸ METAP2 P50579 1/20 0.48

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
SCHEMBL7852410 0.91 JAK3 (0.55) JAK3JAK1LCKDOT1LAKT2
SCHEMBL28068350 0.84 JAK3 (0.67) JAK3JAK1LCKDOT1LAKT2
SCHEMBL28887147 0.84 JAK3 (0.67) JAK3JAK1LCKDOT1LAKT2
SCHEMBL6743217 0.84 JAK3 (0.67) JAK3JAK1LCKDOT1LAKT2
SCHEMBL3951466 0.83 JAK3 (0.71) JAK3JAK1LCKDOT1LAKT2
SCHEMBL2018758 0.81 JAK3 (0.43) JAK3JAK1JAK2SCN9AFFAR2
SCHEMBL2018756 0.81 JAK3 (0.43) JAK3JAK1JAK2SCN9AFFAR2
SCHEMBL3959625 0.81 JAK3 (0.68) JAK3JAK1LCKDOT1LAKT2
SCHEMBL29869816 0.81 ROCK2 (0.65) JAK3JAK1AKT2JAK2METAP2
SCHEMBL6742185 0.81 JAK3 (0.67) JAK3JAK1LCKDOT1LAKT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569569-B2 Pyrrolo[2,3-d]pyrimidine compounds PFIZER INC. (US) 2009-08-04 — — US disclosed
EP-1087971-B1 PYRROLO 2,3-d]PYRIMIDINE COMPOUNDS PFIZER PROD INC (US) 2004-07-07 — — EP disclosed
US-20040058922-A1 Pyrrolo[2,3-d]pyrimidine compounds PFIZER INC. 2004-03-25 — — US disclosed
US-6635762-B1 Protein tyrosine kinase or Janus Kinase 3 inhibitors; immunosuppressants PFIZER INC. 2003-10-21 — — 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-20040058922-A1 Pyrrolo[2,3-d]pyrimidine compounds JAK1, JAK3, JAK2 JAK3 2/4885JAK1 1/4885LCK 4/4885

“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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