SCHEMBL574384

SCHEMBL574384

CC(C)(C)n1cc(NC(=O)Nc2ccc(Oc3ccnc(-c4cnn(CC(N)=O)c4)c3)cc2F)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.46
MAPK14 Q16539 3/20 0.44
FGFR1 P11362 2/20 0.44
PDGFRB P09619 3/20 0.43
PDGFRA P16234 3/20 0.43
FLT3 P36888 3/20 0.43
CSF1R P07333 2/20 0.43
MET P08581 2/20 0.43
FLT1 P17948 3/20 0.43
BRAF P15056 5/20 0.43
ABL1 P00519 2/20 0.43
RIPK2 O43353 1/20 0.43
ABCB11 O95342 1/20 0.43
RAF1 P04049 1/20 0.43
NR3C1 P04150 1/20 0.43
RET P07949 1/20 0.43
HTR1A P08908 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
KIT P10721 1/20 0.43
CHRM1 P11229 1/20 0.43

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
SCHEMBL573470 0.92 KDR (0.48) KDRMAPK14FGFR1PDGFRBPDGFRA
SCHEMBL574161 0.91 KDR (0.49) KDRMAPK14FGFR1PDGFRBPDGFRA
SCHEMBL573892 0.90 KDR (0.48) KDRMAPK14FGFR1PDGFRBPDGFRA
SCHEMBL828291 0.89 KDR (0.45) KDRMAPK14FGFR1PDGFRBPDGFRA
SCHEMBL828556 0.88 KDR (0.46) KDRMAPK14PDGFRBPDGFRAFLT3
SCHEMBL574327 0.88 KDR (0.47) KDRMAPK14FGFR1PDGFRBPDGFRA
SCHEMBL573813 0.87 KDR (0.59) KDRFGFR1PDGFRBPDGFRAFLT3
SCHEMBL573781 0.87 KDR (0.52) KDRMAPK14PDGFRBPDGFRAFLT3
SCHEMBL828935 0.86 KDR (0.47) KDRFGFR1PDGFRBPDGFRAFLT3
SCHEMBL573466 0.84 KDR (0.58) KDRPDGFRBPDGFRAFLT3CSF1R

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 KDR 2434/4885MAPK14 207/4885FGFR1 678/4885
US-20080261965-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES KIT, PRKACA, BRAF KDR 239/4885MAPK14 264/4885FGFR1 233/4885

“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.