SCHEMBL1346579

SCHEMBL1346579

Cc1cc[nH]c(=O)c1CC1CCC1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.35
▸ JAK1 P23458 5/20 0.35
▸ DAO P14920 1/20 0.35
▸ TYK2 P29597 1/20 0.34
▸ JAK3 P52333 1/20 0.34
▸ BRD4 O60885 2/20 0.34
▸ PDE9A O76083 3/20 0.33
▸ EZH2 Q15910 1/20 0.33
▸ MAP2K1 Q02750 1/20 0.33
▸ ROCK1 Q13464 1/20 0.33
▸ ROCK2 O75116 1/20 0.32
▸ PARP15 Q460N3 1/20 0.31
▸ PARP10 Q53GL7 1/20 0.31

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
SCHEMBL1346674 0.95 DAO (0.41) JAK2JAK1DAOBRD4PDE9A
SCHEMBL8126131 0.83 DAO (0.40) DAOBRD4ROCK1
SCHEMBL2172919 0.72 DAO (0.38) JAK2JAK1DAOBRD4ROCK1
SCHEMBL10110509 0.72 NOS3 (0.35) DAOBRD4EZH2
SCHEMBL17060505 0.71 DAO (0.34) DAOBRD4EZH2PARP15
SCHEMBL9284095 0.71 AURKA (0.34) JAK2DAOBRD4
SCHEMBL1346299 0.69 IDH1 (0.49) DAO
SCHEMBL27157561 0.69 DAO (0.36) JAK2JAK1DAOTYK2JAK3
SCHEMBL1346010 0.68 GPR84 (0.43) DAO
SCHEMBL15566612 0.65 BRD9 (0.32) —

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-8063055-B2 Substituted pyridone compounds and methods of use AMGEN INC. (US) 2011-11-22 — — US disclosed
US-20100160312-A1 Substituted Pyridone Compounds and Methods of Use AMGEN INC. (US) 2010-06-24 — — US disclosed
US-7700607-B2 Substituted pyridone compounds and methods of use AMGEN INC. 2010-04-20 — — US disclosed
US-20080249090-A1 Substituted pyridone compounds and methods of use AMGEN INC. (US) 2008-10-09 — — 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 (2 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-20100160312-A1 Substituted Pyridone Compounds and Methods of Use KIT, CMA1, C3AR1 JAK2 174/4885JAK1 158/4885DAO 1887/4885
US-20080249090-A1 Substituted pyridone compounds and methods of use KIT, CMA1, C3AR1 JAK2 174/4885JAK1 158/4885DAO 1887/4885

“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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