SCHEMBL12124641

SCHEMBL12124641

O=C(Nc1ccccc1)c1csc2cc(Oc3cc(CO)ncn3)ccc12

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.56
FLT1 P17948 2/20 0.56
FLT4 P35916 2/20 0.56
RET P07949 1/20 0.56
PDGFRB P09619 1/20 0.56
KIT P10721 1/20 0.56
MAP2K7 O14733 1/20 0.45
LOX P28300 4/20 0.42
LOXL2 Q9Y4K0 4/20 0.42
TNNI3K Q59H18 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
SIRT3 Q9NTG7 1/20 0.40
HTR2C P28335 1/20 0.40
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL1325368 0.88 KDR (0.52) KDRFLT1FLT4RETPDGFRB
SCHEMBL1325348 0.88 KDR (0.75) KDRFLT1FLT4RETPDGFRB
SCHEMBL1325423 0.88 KDR (0.62) KDRFLT1FLT4RETPDGFRB
SCHEMBL1325285 0.87 KDR (0.53) KDRFLT1FLT4RETPDGFRB
SCHEMBL1325008 0.87 KDR (0.59) KDRFLT1FLT4RETPDGFRB
SCHEMBL4313245 0.86 KDR (0.44) KDRFLT1FLT4RETPDGFRB
SCHEMBL1324953 0.83 KDR (0.57) KDRFLT1FLT4RETPDGFRB
SCHEMBL1324765 0.83 KDR (0.55) KDRFLT1FLT4RETPDGFRB
SCHEMBL278840 0.82 KDR (0.78) KDRFLT1FLT4RETPDGFRB
SCHEMBL12124621 0.82 KDR (0.52) KDRFLT1FLT4RETPDGFRB

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
US-8058276-B2 Heterobicyclic carboxamides as inhibitors for kinases NOVARTIS AG (CH) 2011-11-15 US disclosed
US-20090030009-A1 Heterobicyclic Carboxamides as Inhibitors for Kinases NOVARTIS AG (CH) 2009-01-29 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-20090030009-A1 Heterobicyclic Carboxamides as Inhibitors for Kinases PHKG1, MAP3K20, CDK2 KDR 1285/4885FLT1 1391/4885FLT4 2012/4885

“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.