SCHEMBL4655849

SCHEMBL4655849

CCOC(=O)c1cnn2c(-c3cccc(NC(=O)Nc4ccc(OC)c(Cl)c4)c3)ccnc12

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.75
KDR P35968 1/20 0.53
MAPK13 O15264 2/20 0.51
PIM1 P11309 2/20 0.51
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
DAPK3 O43293 1/20 0.48
AKT1 P31749 1/20 0.48
MAPK9 P45984 1/20 0.48
GSK3A P49840 1/20 0.48
NEK2 P51955 1/20 0.48
PIM3 Q86V86 1/20 0.48
PLK3 Q9H4B4 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
SCHEMBL4656739 0.92 BRAF (0.82) BRAFKDRMAPK13PIM1GSK3A
SCHEMBL4658295 0.91 BRAF (0.78) BRAFKDRMAPK13PIM1GSK3A
SCHEMBL4657106 0.91 BRAF (0.80) BRAFMAPK13PIM1MAPTDAPK3
SCHEMBL4657261 0.89 BRAF (0.80) BRAFKDRMAPK13PIM1GSK3A
SCHEMBL5622917 0.89 BRAF (0.76) BRAFKDRMAPK13PIM1GSK3A
SCHEMBL4657124 0.89 BRAF (0.80) BRAFKDRMAPK13PIM1GSK3A
SCHEMBL4655884 0.88 BRAF (0.77) BRAFKDRMAPK13PIM1GSK3A
SCHEMBL5622102 0.88 BRAF (0.76) BRAFKDRMAPK13PIM1GSK3A
SCHEMBL4655862 0.87 BRAF (0.81) BRAFKDRMAPK13PIM1GSK3A
SCHEMBL4657338 0.87 BRAF (0.81) BRAFKDRMAPK13PIM1GSK3A

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-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 289/4885KDR 3374/4885MAPK13 3288/4885

“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.