SCHEMBL4904235

SCHEMBL4904235

c1cc(Cn2ccnn2)cc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)c1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 3/20 0.70
▸ MAPK10 P53779 3/20 0.70
▸ JAK2 O60674 15/20 0.65
▸ JAK3 P52333 4/20 0.56
▸ JAK1 P23458 2/20 0.56
▸ TYK2 P29597 2/20 0.56
▸ CAMK2D Q13557 1/20 0.55
▸ SMG1 Q96Q15 1/20 0.52

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
SCHEMBL4781572 0.85 JAK2 (0.64) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL3756063 0.83 MAPK8 (1.00) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL4734676 0.81 JAK2 (0.71) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL13724670 0.80 JAK2 (0.69) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL12801112 0.79 JAK2 (1.00) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL12274649 0.79 JAK2 (0.77) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL12274500 0.79 CAMK2D (0.81) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL13725012 0.79 JAK2 (0.67) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL30052705 0.79 JAK2 (1.00) MAPK8MAPK10JAK2JAK3JAK1
SCHEMBL2880284 0.79 JAK2 (1.00) MAPK8MAPK10JAK2JAK3JAK1

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-20080153822-A1 Methods of treating pain INGENIUM PHARMACEUTICALS GMBH (DE) 2008-06-26 — — 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-20080153822-A1 Methods of treating pain OPRL1, ACHE, OPRK1 MAPK8 4409/4885MAPK10 3727/4885JAK2 3086/4885

“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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