SCHEMBL3498115

SCHEMBL3498115

CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccnc3c(-c4ccc(Cl)c5[nH]ncc45)c(-c4ccncc4)nn23)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.63
ABL1 P00519 2/20 0.47
MAPK14 Q16539 2/20 0.47
EGFR P00533 1/20 0.47
RAF1 P04049 1/20 0.47
LCK P06239 1/20 0.47
YES1 P07947 1/20 0.47
RET P07949 1/20 0.47
EPHA1 P21709 1/20 0.47
TEK Q02763 1/20 0.47
CHEK1 O14757 1/20 0.46
PRKCB P05771 1/20 0.46
FYN P06241 1/20 0.46
CDK1 P06493 1/20 0.46
LYN P07948 1/20 0.46
MET P08581 1/20 0.46
HCK P08631 1/20 0.46
SRC P12931 1/20 0.46
PDGFRA P16234 1/20 0.46
PRKCA P17252 1/20 0.46

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
SCHEMBL1016431 0.92 BRAF (0.75) BRAFABL1MAPK14EGFRRAF1
SCHEMBL3495598 0.92 BRAF (0.75) BRAFABL1MAPK14EGFRRAF1
SCHEMBL3497135 0.88 BRAF (0.63) BRAFABL1MAPK14EGFRRAF1
SCHEMBL3496860 0.86 BRAF (0.67) BRAFABL1MAPK14EGFRRAF1
SCHEMBL3496952 0.86 BRAF (0.67) BRAFABL1MAPK14EGFRRAF1
SCHEMBL3495878 0.86 BRAF (0.84) BRAFABL1MAPK14EGFRRAF1
SCHEMBL1019435 0.85 BRAF (0.75) BRAFABL1MAPK14EGFRRAF1
SCHEMBL1019434 0.85 BRAF (0.75) BRAFABL1MAPK14EGFRRAF1
SCHEMBL1013101 0.85 BRAF (0.66) BRAFABL1MAPK14EGFRRAF1
SCHEMBL1019130 0.82 BRAF (0.76) BRAFABL1MAPK14EGFRRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029657-A1 Bridged, Bicyclic Heterocyclic or Spiro Bicyclic Heterocyclic Derivatives of Pyrazolo[1, 5-A]Pyrimidines, Methods for Preparation and Uses Thereof WYETH (US) 2010-02-04 US claimed
US-20100029657-A1 Bridged, Bicyclic Heterocyclic or Spiro Bicyclic Heterocyclic Derivatives of Pyrazolo[1, 5-A]Pyrimidines, Methods for Preparation and Uses Thereof WYETH (US) 2010-02-04 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-20100029657-A1 Bridged, Bicyclic Heterocyclic or Spiro Bicyclic Heterocyclic Derivatives of Pyrazolo[1, 5-A]Pyrimidines, Methods for Preparation and Uses Thereof BRAF, RAF1, ARAF BRAF 1/4885ABL1 392/4885MAPK14 70/4885

“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.