SCHEMBL4763004

SCHEMBL4763004

CCOC(=O)c1cnn2c(-c3cccc(NC(=O)c4ccccc4)c3)ccnc12

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.80
MAPK13 O15264 2/20 0.61
PIM1 P11309 2/20 0.61
GSK3A P49840 2/20 0.59
EPHA2 P29317 1/20 0.59
LIMK1 P53667 1/20 0.59
MARK2 Q7KZI7 1/20 0.59
MAPK9 P45984 1/20 0.53
DYRK1A Q13627 1/20 0.53
IRAK4 Q9NWZ3 1/20 0.53
AKT1 P31749 1/20 0.52
PIM3 Q86V86 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
SCHEMBL4656020 0.93 BRAF (0.80) BRAFMAPK13PIM1GSK3AEPHA2
SCHEMBL4656655 0.92 BRAF (0.79) BRAFMAPK13PIM1GSK3AEPHA2
SCHEMBL4656627 0.92 BRAF (0.77) BRAFMAPK13PIM1GSK3AEPHA2
SCHEMBL4655936 0.92 BRAF (0.77) BRAFMAPK13PIM1GSK3AEPHA2
SCHEMBL4655831 0.91 BRAF (0.78) BRAFMAPK13PIM1GSK3AEPHA2
SCHEMBL4657095 0.91 BRAF (0.76) BRAFMAPK13PIM1GSK3AEPHA2
SCHEMBL4657096 0.91 BRAF (0.88) BRAF
SCHEMBL4657212 0.91 BRAF (0.84) BRAFMAPK13PIM1GSK3AEPHA2
SCHEMBL4657310 0.90 BRAF (0.77) BRAFMAPK13PIM1GSK3AEPHA2
SCHEMBL4657367 0.90 BRAF (0.81) BRAFMAPK13PIM1GSK3AEPHA2

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
EP-1996594-A2 PYRAZOLO[1,5-A]PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-12-03 EP claimed
WO-2007109093-A2 PYRAZOLO[1,5-A]PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF WYETH (US) 2007-09-27 WO claimed
US-20070219186-A1 Pyrazolo[1,5-A]pyrimidine derivatives and methods of use thereof WYETH (US) 2007-09-20 US claimed
US-20070219186-A1 Pyrazolo[1,5-A]pyrimidine derivatives and methods of use thereof WYETH (US) 2007-09-20 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-20070219186-A1 Pyrazolo[1,5-A]pyrimidine derivatives and methods of use thereof DPYD, TYMP, TYMS BRAF 289/4885MAPK13 3288/4885PIM1 1136/4885

“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.