SCHEMBL573479

SCHEMBL573479

CN1CCN(c2cc(Cl)cc(NC(=O)Nc3cc(Oc4cccc(-c5cn[nH]c5)n4)ccc3F)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 1/20 0.39
KDR P35968 8/20 0.39
IRAK4 Q9NWZ3 3/20 0.39
CTSC P53634 1/20 0.38
CNR1 P21554 2/20 0.38
BRAF P15056 1/20 0.38
MET P08581 1/20 0.38
RIPK1 Q13546 1/20 0.37
TEK Q02763 2/20 0.37
ROCK2 O75116 1/20 0.36

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
SCHEMBL574121 0.93 KDR (0.42) KDRIRAK4CTSCCNR1BRAF
SCHEMBL572653 0.93 CNR1 (0.45) KDRIRAK4CNR1RIPK1
SCHEMBL574231 0.93 MET (0.43) KDRIRAK4CTSCBRAFMET
SCHEMBL574209 0.93 CNR1 (0.44) KDRIRAK4CNR1RIPK1
SCHEMBL574207 0.92 KDR (0.45) KDRBRAFRIPK1TEK
SCHEMBL574238 0.91 NTRK1 (0.44) KDRIRAK4CNR1BRAFMET
SCHEMBL3805067 0.91 CNR1 (0.46) KDRIRAK4CNR1RIPK1
SCHEMBL574391 0.89 IRAK4 (0.48) FGFR3KDRIRAK4CTSCCNR1
SCHEMBL574358 0.88 IRAK4 (0.37) KDRIRAK4CNR1RIPK1ROCK2
SCHEMBL574212 0.87 CNR1 (0.44) KDRIRAK4CNR1RIPK1

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-8143293-B2 disease caused by c-Abl kinase, c-Kit kinase, oncogenic forms, aberrant fusion proteins and polymorphs; 1-(3-t-butylisoxazol-5-yl)-3-(2-fluoro-4-(2-(1-methyl-1H-pyrazol-4-yl)pyridin-4-yloxy)phenyl)urea DECIPHERA PHARMACEUTICALS, LLC (US) 2012-03-27 US disclosed
WO-2012019015-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF MYELOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2012-02-09 WO disclosed
US-20110189167-A1 Methods and Compositions for the Treatment of Myeloproliferative Diseases and other Proliferative Diseases DECIPHERA PHARMACEUTICALS, LLC 2011-08-04 US disclosed
US-20080261965-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-10-23 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-20110189167-A1 Methods and Compositions for the Treatment of Myeloproliferative Diseases and other Proliferative Diseases MCL1, NRAS, ABL1 FGFR3 740/4885KDR 2434/4885IRAK4 1542/4885
US-20080261965-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES KIT, PRKACA, BRAF FGFR3 397/4885KDR 239/4885IRAK4 501/4885

“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.