SCHEMBL574137

SCHEMBL574137

Cc1cn(-c2cc(NC(=O)Nc3ccc(Oc4ccnc(-c5cn[nH]c5)c4)cc3F)cc(C(F)(F)F)c2)cn1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.49
BRAF P15056 3/20 0.49
NR2E1 Q9Y466 6/20 0.49
RAF1 P04049 1/20 0.46
LDLR P01130 1/20 0.46
KIT P10721 1/20 0.46
PCSK9 Q8NBP7 1/20 0.46
NR1I2 O75469 1/20 0.45
ABL1 P00519 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
BCR P11274 1/20 0.45
PTGS1 P23219 1/20 0.45
CHRNA4 P43681 1/20 0.45
PDE3A Q14432 1/20 0.45
RET P07949 1/20 0.45
FLT1 P17948 1/20 0.44

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
SCHEMBL574587 0.94 KDR (0.51) KDRNR2E1RAF1LDLRKIT
SCHEMBL574434 0.91 KDR (0.50) KDRFLT1
SCHEMBL574367 0.91 KDR (0.49) KDRRAF1FLT1
SCHEMBL828849 0.89 KDR (0.54) KDRBRAFNR2E1LDLRKIT
SCHEMBL574451 0.89 KDR (0.60) KDRBRAFNR2E1RAF1LDLR
SCHEMBL574302 0.88 KDR (0.54) KDRFLT1
SCHEMBL828531 0.88 KDR (0.45) KDRBRAFNR2E1RAF1FLT1
SCHEMBL572643 0.86 KDR (0.56) KDRBRAF
SCHEMBL574101 0.86 KDR (0.55) KDRBRAF
SCHEMBL574322 0.85 KDR (0.56) KDRBRAF

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 12/4885NR2E1 2369/4885

“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.