SCHEMBL279328

SCHEMBL279328

NC1CCCN(c2ccc(NC(=O)c3cccc4cc(Oc5cc(NC(=O)C6CC6)ncn5)ccc34)cc2C(F)(F)F)C1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.56
FLT1 P17948 4/20 0.55
FLT4 P35916 4/20 0.55
BRAF P15056 3/20 0.49
RET P07949 1/20 0.47
PDGFRB P09619 1/20 0.47
KIT P10721 1/20 0.47

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
SCHEMBL274221 1.00 KDR (0.56) KDRFLT1FLT4BRAFRET
SCHEMBL273545 0.94 KDR (0.58) KDRFLT1FLT4BRAFRET
SCHEMBL278849 0.94 KDR (0.58) KDRFLT1FLT4BRAFRET
SCHEMBL273272 0.94 KDR (0.58) KDRFLT1FLT4BRAFRET
SCHEMBL274614 0.87 KDR (0.60) KDRFLT1FLT4BRAFRET
SCHEMBL273333 0.84 KDR (0.54) KDRFLT1FLT4BRAFRET
SCHEMBL273571 0.84 KDR (0.54) KDRFLT1FLT4BRAFRET
SCHEMBL274497 0.83 KDR (0.57) KDRFLT1FLT4BRAFRET
SCHEMBL278848 0.82 KDR (0.54) KDRFLT1FLT4BRAFRET
SCHEMBL275088 0.80 HCK (0.60) KDRFLT1FLT4BRAFRET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120122857-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES NOVARTIS AG (CH) 2012-05-17 US disclosed
US-20120122857-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES NOVARTIS AG (CH) 2012-05-17 US disclosed
US-8133886-B2 Heterobicyclic carboxamides as inhibitors for kinases NOVARTIS AG (CH) 2012-03-13 US disclosed
US-8133886-B2 Heterobicyclic carboxamides as inhibitors for kinases NOVARTIS AG (CH) 2012-03-13 US disclosed
US-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers NOVARTIS AG (CH) 2010-02-04 US disclosed
US-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers NOVARTIS AG (CH) 2010-02-04 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 (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-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers SLC8B1, MCU, GLS KDR 3083/4885FLT1 2466/4885FLT4 3490/4885
US-20120122857-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES MAP3K20, PHKG1, PHKG2 KDR 1319/4885FLT1 1353/4885FLT4 1993/4885

“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.