SCHEMBL4805074

SCHEMBL4805074

COc1cc(Cc2nnc(Nc3cccc(CCBr)c3)c3ccccc23)ccn1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 18/20 0.57
FLT1 P17948 9/20 0.57
PDGFRB P09619 8/20 0.57
KIT P10721 7/20 0.57
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
SHMT2 P34897 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
SCHEMBL1929579 0.80 KDR (0.52) KDRFLT1PDGFRBKITMEN1
SCHEMBL6503289 0.74 KDR (0.70) KDRFLT1PDGFRBKITMEN1
SCHEMBL905633 0.73 KDR (1.00) KDRFLT1PDGFRBKITMEN1
SCHEMBL6504661 0.72 KDR (0.49) KDRFLT1PDGFRBKITMEN1
SCHEMBL31583016 0.72 LOXL2 (0.62)
SCHEMBL14486857 0.72 LOXL2 (0.62)
SCHEMBL26907246 0.72 LOX (0.47) KDRFLT1PDGFRBKITMEN1
SCHEMBL905704 0.71 KDR (1.00) KDRFLT1PDGFRBKITMEN1
SCHEMBL13773458 0.70 KDR (0.59) KDRFLT1PDGFRBKIT
SCHEMBL6473753 0.69 KDR (0.53) KDRFLT1PDGFRBKITMEN1

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-7399761-B2 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2008-07-15 US disclosed
US-20040180899-A1 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2004-09-16 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-20040180899-A1 Phthalazine derivatives with angiogenesis inhibiting activity VEGFA, NR5A1, PGF KDR 13/4885FLT1 5/4885PDGFRB 621/4885

“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.