SCHEMBL6309802

SCHEMBL6309802

CNC(=O)c1ccc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](OC)C5)sc34)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.50
FLT1 P17948 10/20 0.50
MET P08581 3/20 0.45
SCN9A Q15858 2/20 0.42
ADORA3 P0DMS8 2/20 0.39
ADORA2A P29274 2/20 0.39
HRH3 Q9Y5N1 2/20 0.39
ADORA2B P29275 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
SCHEMBL5771691 0.91 KDR (0.50) KDRFLT1METSCN9AADORA3
SCHEMBL5771679 0.91 KDR (0.50) KDRFLT1METSCN9AADORA3
SCHEMBL4707942 0.87 KDR (0.49) KDRFLT1METSCN9AADORA3
SCHEMBL4707940 0.87 KDR (0.49) KDRFLT1METSCN9AADORA3
SCHEMBL6310032 0.87 KDR (0.54) KDRFLT1MET
SCHEMBL5241534 0.84 KDR (0.48) KDRFLT1METSCN9AADORA3
SCHEMBL14409880 0.84 KDR (0.48) KDRFLT1METSCN9AADORA3
SCHEMBL5243390 0.84 KDR (0.49) KDRFLT1METADORA3ADORA2A
SCHEMBL6747209 0.84 KDR (0.49) KDRFLT1METSCN9AADORA3
SCHEMBL6747207 0.84 KDR (0.49) KDRFLT1METSCN9AADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050070508-A1 Napthalene carboxamides and their derivatives useful as new anti-angiogenic agents AGOURON PHARMACEUTICALS, INC. 2005-03-31 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-20050070508-A1 Napthalene carboxamides and their derivatives useful as new anti-angiogenic agents CCNA1, CCNA2, CCNT1 KDR 30/4885FLT1 20/4885MET 3202/4885

“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.