SCHEMBL6749145

SCHEMBL6749145

C#CCNC(=O)n1c(C)cc2cc(Oc3ccnc4cc(C(=O)N5CC[C@H](OC)C5)sc34)ccc21

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.48
FLT1 P17948 11/20 0.48
MET P08581 3/20 0.42
SCN9A Q15858 2/20 0.36
ADORA3 P0DMS8 2/20 0.36
ADORA2A P29274 2/20 0.36
ADORA2B P29275 1/20 0.36

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
SCHEMBL6749151 1.00 KDR (0.48) KDRFLT1METSCN9AADORA3
SCHEMBL6749154 1.00 KDR (0.48) KDRFLT1METSCN9AADORA3
SCHEMBL6687875 0.94 KDR (0.46) KDRFLT1METSCN9AADORA3
SCHEMBL6664885 0.93 KDR (0.47) KDRFLT1METSCN9AADORA3
SCHEMBL6664180 0.92 KDR (0.47) KDRFLT1METSCN9AADORA3
SCHEMBL6750890 0.92 KDR (0.47) KDRFLT1MET
SCHEMBL6750891 0.92 KDR (0.47) KDRFLT1MET
SCHEMBL6660904 0.92 KDR (0.47) KDRFLT1MET
SCHEMBL6747209 0.91 KDR (0.49) KDRFLT1METSCN9AADORA3
SCHEMBL6749144 0.91 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833456-B2 Heterocyclic sulfides such as 5-(2-(2R-Hydroxymethyl-pyrrolidine-1-carbonyl)-thieno(3,2-b)pyridin-7 -ylamino)-2-methyl-indole-1-carboxylic acid methylamide, used as angiogenesis inhibitors AGOURON PHARMACEUTICALS, INC. 2004-12-21 US disclosed
US-20040019065-A1 Indolyl-urea derivatives of thienopyridines useful as antiangiogenic agents, and methods for their use ROMINES WILLIAM HENRY (US) 2004-01-29 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-20040019065-A1 Indolyl-urea derivatives of thienopyridines useful as antiangiogenic agents, and methods for their use CDKN1A, CCNA1, TYMP KDR 62/4885FLT1 12/4885MET 2583/4885

“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.