SCHEMBL3583945

SCHEMBL3583945

O=C1NCc2[nH]c3c(ccc4cnc(Cl)cc43)c21

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 19/20 0.62
MAPK9 P45984 13/20 0.62
CDC7 O00311 1/20 0.49

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
SCHEMBL3569556 0.88 MAPKAPK2 (0.49) MAPKAPK2MAPK9CDC7
SCHEMBL3577945 0.88 CDC7 (0.66) MAPKAPK2MAPK9CDC7
SCHEMBL3574331 0.85 MAPKAPK2 (0.65) MAPKAPK2MAPK9CDC7
SCHEMBL3580005 0.81 MAPKAPK2 (0.43) MAPKAPK2MAPK9CDC7
SCHEMBL3569341 0.81 MAPKAPK2 (0.55) MAPKAPK2MAPK9CDC7
SCHEMBL3571127 0.80 MAPKAPK2 (0.66) MAPKAPK2MAPK9CDC7
SCHEMBL3584751 0.79 MAPKAPK2 (0.69) MAPKAPK2MAPK9CDC7
SCHEMBL3581621 0.79 MAPKAPK2 (0.76) MAPKAPK2MAPK9CDC7
SCHEMBL3632140 0.79 CDC7 (0.76) MAPKAPK2MAPK9CDC7
SCHEMBL3575771 0.79 DYRK1A (0.53) MAPKAPK2MAPK9CDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100069360-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-03-18 US claimed
US-20100069360-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-03-18 US disclosed
US-20100069360-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-03-18 US disclosed
US-20100069360-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-03-18 US disclosed
EP-2064212-A1 PYRROLO ISOQUINOLINES AS KINASE INHIBITORS Novartis AG (CH) 2009-06-03 EP disclosed
WO-2008025512-A1 PYRROLO ISOQUINOLINES AS KINASE INHIBITORS NOVARTIS AG (CH) 2008-03-06 WO disclosed
WO-2008025512-A1 PYRROLO ISOQUINOLINES AS KINASE INHIBITORS NOVARTIS AG (CH) 2008-03-06 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-20100069360-A1 ORGANIC COMPOUNDS SLCO1B3, CYP3A7, SLCO1B1 MAPKAPK2 4563/4885MAPK9 2834/4885CDC7 3142/4885

“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.