SCHEMBL5209249

SCHEMBL5209249

COc1cc(CNc2cncc(-c3ccc(O)c(OC)c3)n2)cc(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FYN P06241 5/20 0.61
BRAF P15056 7/20 0.52
CALM1 P0DP23 1/20 0.45
CSF1R P07333 3/20 0.43
GAA P10253 1/20 0.42
RECQL P46063 1/20 0.42
GFER P55789 1/20 0.42
MAPK1 P28482 1/20 0.41
PIK3CA P42336 1/20 0.41
MAPK8 P45983 1/20 0.41
MAPK9 P45984 1/20 0.41
MAPK10 P53779 1/20 0.41
PIM1 P11309 1/20 0.41
PIM3 Q86V86 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
CXCL12 P48061 1/20 0.40

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
SCHEMBL5205278 0.85 FYN (0.53) FYNBRAFCSF1RGAARECQL
SCHEMBL5210710 0.84 CLK4 (0.53) FYNBRAFCSF1RCXCL12
SCHEMBL5204384 0.80 PIK3CG (0.60) FYNBRAFCSF1RGAAMAPK1
SCHEMBL12065316 0.79 FYN (0.57) FYNBRAFCSF1RGAARECQL
SCHEMBL12056818 0.77 FYN (0.55) FYNBRAFCSF1RMAPK1PIK3CA
SCHEMBL12056775 0.77 FYN (0.55) FYNBRAFCSF1RMAPK1PIK3CA
SCHEMBL18613216 0.77 FYN (1.00) FYNBRAFGAARECQLGFER
SCHEMBL5208271 0.75 FYN (0.67) FYNBRAFCSF1RGAAPIM3
SCHEMBL5934776 0.75 FYN (0.67) FYNBRAFCSF1RGAAPIM3
SCHEMBL14394170 0.74 FYN (0.51) FYNBRAFCSF1RGAARECQL

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-1513821-B1 PROTEIN KINASE INHIBITORS CYTOPIA PTY LTD (AU) 2007-10-31 EP disclosed
US-7122550-B2 Protein kinase inhibitors CYTOPIA PTY LTD (AU) 2006-10-17 US disclosed
US-20060148824-A1 Protein kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2006-07-06 US disclosed
US-20040235862-A1 For therapy of atopy, a cell mediated hypersensitivity, a rheumatic disease, an autoimmune disease, a viral disease, and a cancer YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2004-11-25 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 (2 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-20040235862-A1 For therapy of atopy, a cell mediated hypersensitivity, a rheumatic disease, an autoimmune disease, a viral disease, and a cancer LCK, IRAK1, MAP2K5 FYN 498/4885BRAF 89/4885CALM1 1062/4885
US-20060148824-A1 Protein kinase inhibitors MAP3K20, MAP4K2, MAP3K1 FYN 359/4885BRAF 49/4885CALM1 586/4885

“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.