SCHEMBL1771897

SCHEMBL1771897

CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]cc(C(=O)OC)c3c2)c1F

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.80
BMPR1B O00238 1/20 0.65
PLK4 O00444 1/20 0.65
PIR O00625 1/20 0.65
AURKA O14965 1/20 0.65
DCLK1 O15075 1/20 0.65
EPHB6 O15197 1/20 0.65
RIPK2 O43353 1/20 0.65
STK16 O75716 1/20 0.65
OXSR1 O95747 1/20 0.65
MAP4K4 O95819 1/20 0.65
ABL1 P00519 1/20 0.65
RAF1 P04049 1/20 0.65
LCK P06239 1/20 0.65
FYN P06241 1/20 0.65
FES P07332 1/20 0.65
CSF1R P07333 1/20 0.65
YES1 P07947 1/20 0.65
LYN P07948 1/20 0.65
HCK P08631 1/20 0.65

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
SCHEMBL1772520 0.93 BRAF (0.84) BRAFBMPR1BPLK4PIRAURKA
SCHEMBL1772225 0.91 BRAF (0.80) BRAFBMPR1BPLK4PIRAURKA
SCHEMBL1772878 0.90 BRAF (0.88) BRAF
SCHEMBL1772313 0.90 BRAF (0.79) BRAFBMPR1BPLK4PIRAURKA
SCHEMBL1773657 0.89 BRAF (0.80) BRAFBMPR1BPLK4PIRAURKA
SCHEMBL1772611 0.89 BRAF (0.77) BRAFBMPR1BPLK4PIRAURKA
SCHEMBL1771880 0.89 BRAF (0.79) BRAFBMPR1BPLK4PIRAURKA
SCHEMBL1773556 0.88 BRAF (1.00) BRAF
SCHEMBL1773243 0.88 BRAF (1.00) BRAF
SCHEMBL1771749 0.88 BRAF (0.77) BRAFBMPR1BPLK4PIRAURKA

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-8338452-B2 Raf inhibitor compounds and methods of use thereof ARRAY BIOPHARMA INC. (US) 2012-12-25 US disclosed
US-8338452-B2 Raf inhibitor compounds and methods of use thereof ARRAY BIOPHARMA INC. (US) 2012-12-25 US disclosed
US-20110110889-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Bio Pharma Inc. (US) 2011-05-12 US disclosed
US-20110110889-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Bio Pharma Inc. (US) 2011-05-12 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-20110110889-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF BRAF 1/4885BMPR1B 4000/4885PLK4 455/4885

“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.