SCHEMBL1260248

SCHEMBL1260248

NC(=O)C1(C(=O)N(c2ccc(F)cc2)c2ccc(Oc3ccc4nc(NC(=O)C5CC5)cn4c3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 6/20 0.47
▸ KDR P35968 8/20 0.45
▸ FLT1 P17948 2/20 0.45
▸ AURKA O14965 1/20 0.45
▸ PDGFRB P09619 1/20 0.45
▸ KIT P10721 1/20 0.45
▸ LRRK2 Q5S007 6/20 0.41
▸ MET P08581 4/20 0.41
▸ FLT4 P35916 1/20 0.40
▸ CSNK1D P48730 2/20 0.38
▸ CSNK1E P49674 2/20 0.38
▸ BRAF P15056 1/20 0.37
▸ MAP4K1 Q92918 1/20 0.37

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
SCHEMBL1258102 0.92 KDR (0.46) ABL1KDRFLT1AURKAPDGFRB
SCHEMBL1260496 0.91 KDR (0.49) ABL1KDRFLT1AURKAPDGFRB
SCHEMBL1259285 0.91 KDR (0.45) ABL1KDRFLT1AURKAPDGFRB
SCHEMBL1258960 0.86 KDR (0.53) ABL1KDRFLT1AURKAPDGFRB
Hydrochloric Acid SCHEMBL1260026 0.85 KDR (0.53) ABL1KDRFLT1AURKAPDGFRB
SCHEMBL1259174 0.82 KDR (0.48) ABL1KDRFLT1AURKAPDGFRB
SCHEMBL1260246 0.82 KDR (0.51) ABL1KDRFLT1AURKAPDGFRB
SCHEMBL1258121 0.76 KDR (0.55) ABL1KDRFLT1AURKAPDGFRB
SCHEMBL1259283 0.75 KDR (0.58) ABL1KDRFLT1AURKAPDGFRB
SCHEMBL1258100 0.74 KDR (0.53) ABL1KDRFLT1AURKAPDGFRB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445509-B2 Fused heterocyclic derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-05-21 — — US disclosed
US-20110046169-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-02-24 — — US disclosed
WO-2009136663-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-12 — — WO 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-20110046169-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF ABL1, MAP4K2, MAP3K20 ABL1 1/4885KDR 966/4885FLT1 1499/4885

“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.

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