SCHEMBL986677

SCHEMBL986677

CCOC(=O)c1c[nH]c2c(-c3cc(C)ccc3OCC3CC3)ncnc12

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.43
JAK3 P52333 19/20 0.43
KDM2B Q8NHM5 1/20 0.40
KDM4C Q9H3R0 1/20 0.40

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
SCHEMBL984731 0.91 JAK3 (0.45) JAK2JAK3
SCHEMBL981064 0.90 JAK3 (0.46) JAK2JAK3
SCHEMBL983435 0.90 JAK3 (0.40) JAK2JAK3
SCHEMBL983691 0.90 KDM4C (0.46) JAK2JAK3KDM2BKDM4C
SCHEMBL983115 0.89 JAK3 (0.47) JAK2JAK3
SCHEMBL983088 0.86 JAK3 (0.46) JAK2JAK3KDM4C
SCHEMBL986033 0.86 CSNK2A2 (0.38) JAK2JAK3KDM2BKDM4C
SCHEMBL986034 0.86 CSNK2A2 (0.38) JAK2JAK3KDM2BKDM4C
SCHEMBL983194 0.85 JAK3 (0.38) JAK2JAK3
SCHEMBL983134 0.85 JAK3 (0.46) JAK2JAK3

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-8445501-B2 Substituted 7-carboxamido-pyrrolo[3,2-d]pyrimidines TAKEDA GMBH (DE) 2013-05-21 US disclosed
US-20110021479-A1 PYRROLOPYRIMIDINECARBOXAMIDES NYCOMED GMBH (DE) 2011-01-27 US disclosed
EP-2247594-A1 PYRROLOPYRIMIDINECARBOXAMIDES Nycomed GmbH (DE) 2010-11-10 EP disclosed
WO-2009106531-A1 PYRROLOPYRIMIDINECARBOXAMIDES NYCOMED GMBH (DE) 2009-09-03 WO 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-20110021479-A1 PYRROLOPYRIMIDINECARBOXAMIDES PDE5A, PDE3A, PDE2A JAK2 1660/4885JAK3 1732/4885KDM2B 831/4885

“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.