SCHEMBL574737

SCHEMBL574737

O=C(Nc1cncc(C(F)(F)F)c1)Nc1ccc(Oc2ccnc(-c3cnn(CCO)c3)c2)cc1F

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.60
BRAF P15056 10/20 0.47
RAF1 P04049 1/20 0.43
ABL1 P00519 1/20 0.43
PDGFRB P09619 2/20 0.42
PDGFRA P16234 2/20 0.42
AURKA O14965 1/20 0.42
KIT P10721 1/20 0.42
FLT1 P17948 1/20 0.42
TEK Q02763 1/20 0.42
PTK2 Q05397 1/20 0.42
CSF1R P07333 1/20 0.42
MET P08581 1/20 0.42
FLT3 P36888 1/20 0.42
AXL P30530 1/20 0.42

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
SCHEMBL574452 0.93 KDR (0.54) KDRBRAFABL1PDGFRBPDGFRA
SCHEMBL827815 0.93 KDR (0.54) KDRBRAFRAF1CSF1R
SCHEMBL574540 0.92 KDR (0.60) KDRBRAFRAF1ABL1PDGFRB
SCHEMBL828131 0.92 KDR (0.56) KDRBRAFRAF1ABL1PDGFRB
SCHEMBL573466 0.91 KDR (0.58) KDRBRAFRAF1PDGFRBPDGFRA
SCHEMBL826920 0.90 KDR (0.57) KDRBRAFRAF1PDGFRBPDGFRA
SCHEMBL2264354 0.90 KDR (0.56) KDRBRAFRAF1CSF1R
SCHEMBL572509 0.90 KDR (0.64) KDRBRAFPDGFRBPDGFRAAURKA
SCHEMBL826835 0.90 KDR (0.52) KDRBRAFABL1PDGFRBPDGFRA
SCHEMBL574521 0.87 AXL (0.46) KDRPDGFRBPDGFRAAURKAFLT1

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
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

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-20110189167-A1 Methods and Compositions for the Treatment of Myeloproliferative Diseases and other Proliferative Diseases MCL1, NRAS, ABL1 KDR 2434/4885BRAF 12/4885RAF1 17/4885

“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.