SCHEMBL573650

SCHEMBL573650

O=C(Nc1cc(N2CCCC2)cc(C(F)(F)F)c1)Nc1cc(Oc2cccc(-c3cn[nH]c3)n2)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.49
RIPK1 Q13546 1/20 0.44
TEK Q02763 4/20 0.42
BRAF P15056 6/20 0.41
NTRK1 P04629 2/20 0.40
MAPK14 Q16539 1/20 0.39
TNNI3K Q59H18 1/20 0.39

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
SCHEMBL573369 0.99 KDR (0.49) KDRRIPK1TEKBRAFNTRK1
SCHEMBL574207 0.94 KDR (0.45) KDRRIPK1TEKBRAFNTRK1
SCHEMBL573612 0.94 KDR (0.51) KDRRIPK1TEKBRAFNTRK1
SCHEMBL572653 0.91 CNR1 (0.45) KDRRIPK1
SCHEMBL573446 0.91 RIPK1 (0.42) KDRRIPK1TEKBRAFNTRK1
SCHEMBL574209 0.90 CNR1 (0.44) KDRRIPK1
SCHEMBL574212 0.90 CNR1 (0.44) KDRRIPK1
SCHEMBL574017 0.90 NTRK1 (0.43) KDRRIPK1NTRK1
SCHEMBL827574 0.89 NTRK1 (0.48) KDRRIPK1TEKBRAFNTRK1
SCHEMBL574134 0.89 CNR1 (0.43) KDRRIPK1

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 2434/4885RIPK1 1293/4885TEK 3102/4885

“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.