SCHEMBL4655935

SCHEMBL4655935

CCOC(=O)c1cnn2c(-c3cccc(NC(=O)Cc4cccc(C)c4)c3)ccnc12

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRAF P15056 13/20 0.66
TLR8 Q9NR97 1/20 0.54
KDR P35968 1/20 0.53
MAPK13 O15264 2/20 0.49
PIM1 P11309 1/20 0.49
LIMK1 P53667 1/20 0.49
MARK2 Q7KZI7 1/20 0.49
PSEN1 P49768 1/20 0.48
PSEN2 P49810 1/20 0.48
APH1B Q8WW43 1/20 0.48
NCSTN Q92542 1/20 0.48
APH1A Q96BI3 1/20 0.48
PSENEN Q9NZ42 1/20 0.48

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
SCHEMBL4655980 0.92 BRAF (0.64) BRAFTLR8KDRMAPK13PIM1
SCHEMBL4657350 0.92 BRAF (0.67) BRAFTLR8KDRMAPK13PIM1
SCHEMBL4656318 0.92 BRAF (0.65) BRAFTLR8KDRMAPK13PIM1
SCHEMBL4655928 0.91 BRAF (0.65) BRAFMAPK13PIM1LIMK1MARK2
SCHEMBL4656565 0.90 BRAF (0.81) BRAF
SCHEMBL4656834 0.89 BRAF (0.68) BRAFKDRMAPK13PIM1LIMK1
SCHEMBL4658139 0.88 BRAF (0.66) BRAFMAPK13PIM1LIMK1MARK2
SCHEMBL4656094 0.87 BRAF (0.77) BRAF
SCHEMBL4656112 0.86 BRAF (0.60) BRAFKDRMAPK13PIM1LIMK1
SCHEMBL4656020 0.86 BRAF (0.80) BRAFTLR8KDRMAPK13PIM1

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
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
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 disclosed
WO-2007109093-A2 PYRAZOLO[1,5-A]PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF WYETH (US) 2007-09-27 WO disclosed
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 289/4885TLR8 3604/4885KDR 3374/4885

“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.