SCHEMBL13678271

SCHEMBL13678271

CCCC(CC#N)c1ncc(-c2ncnc3c2CCN3)o1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.43
▸ JAK1 P23458 1/20 0.43
▸ NNMT P40261 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
SCHEMBL21974618 0.78 JAK2 (0.43) JAK2JAK1
SCHEMBL29540631 0.74 JAK2 (0.50) JAK2JAK1
SCHEMBL101240 0.74 JAK2 (0.50) JAK2JAK1
SCHEMBL18599491 0.71 JAK2 (0.39) JAK2JAK1
SCHEMBL21975050 0.71 JAK2 (0.66) JAK2JAK1
SCHEMBL19062726 0.67 JAK2 (0.39) JAK2JAK1NNMT
SCHEMBL13678279 0.65 JAK2 (0.70) JAK2JAK1
SCHEMBL18602154 0.65 JAK2 (0.48) JAK2JAK1
SCHEMBL21974567 0.63 JAK2 (0.37) JAK2JAK1NNMT
SCHEMBL18599970 0.63 JAK2 (0.37) JAK2JAK1NNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7598257-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as janus kinase inhibitors INCYTE CORPORATION (US) 2009-10-06 — — US disclosed
US-20070135461-A1 3-Cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrile; immune-related diseases, skin disorders, myeloid proliferative disorders, cancer INCYTE CORPORATION 2007-06-14 — — 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-20070135461-A1 3-Cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrile; immune-related diseases, skin disorders, myeloid proliferative disorders, cancer JAK1, JAK3, MAP3K4 JAK2 4/4885JAK1 1/4885NNMT 1766/4885

“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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