SCHEMBL3578743

SCHEMBL3578743

O=C1NCCc2[nH]c3c(ccc4cnc(C=Cc5cccc(N6CCOCC6)c5)cc43)c21

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 17/20 0.54
MAPK9 P45984 13/20 0.54
CDC7 O00311 1/20 0.46
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL3578740 1.00 MAPKAPK2 (0.54) MAPKAPK2MAPK9CDC7PIM1PIM2
SCHEMBL3574365 0.95 MAPKAPK2 (0.54) MAPKAPK2MAPK9CDC7MAPT
SCHEMBL3574369 0.95 MAPKAPK2 (0.54) MAPKAPK2MAPK9CDC7MAPT
SCHEMBL3577156 0.92 MAPKAPK2 (0.53) MAPKAPK2MAPK9CDC7MAPT
SCHEMBL3577154 0.92 MAPKAPK2 (0.53) MAPKAPK2MAPK9CDC7MAPT
SCHEMBL3577913 0.86 MAPKAPK2 (0.58) MAPKAPK2MAPK9CDC7
SCHEMBL3577917 0.86 MAPKAPK2 (0.58) MAPKAPK2MAPK9CDC7
SCHEMBL3570153 0.85 MAPKAPK2 (0.60) MAPKAPK2MAPK9CDC7
SCHEMBL3570156 0.85 MAPKAPK2 (0.60) MAPKAPK2MAPK9CDC7
SCHEMBL3574169 0.84 MAPKAPK2 (0.41) MAPKAPK2MAPK9PIM1PIM2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100069360-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-03-18 US claimed
EP-2064212-A1 PYRROLO ISOQUINOLINES AS KINASE INHIBITORS Novartis AG (CH) 2009-06-03 EP claimed
WO-2008025512-A1 PYRROLO ISOQUINOLINES AS KINASE INHIBITORS NOVARTIS AG (CH) 2008-03-06 WO claimed
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

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.