SCHEMBL6750894

SCHEMBL6750894

CNC(=O)c1c(C)[nH]c2ccc(Oc3ccnc4cc(C(=O)N5CCC[C@@H]5COC)sc34)cc12

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.40
FLT1 P17948 12/20 0.40
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
RAB9A P51151 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
SCHEMBL6632827 0.93 KDR (0.40) KDRFLT1KDM4EGAATLR8
SCHEMBL6753076 0.93 KDR (0.40) KDRFLT1KDM4EGAATLR8
SCHEMBL6638049 0.92 KDR (0.40) KDRFLT1KDM4EGAATLR8
SCHEMBL5242111 0.86 KDR (0.45) KDRFLT1RAB9A
SCHEMBL5242758 0.85 KDR (0.44) KDRFLT1RAB9A
SCHEMBL5241211 0.85 KDR (0.44) KDRFLT1RAB9A
SCHEMBL6635542 0.83 KDR (0.40) KDRFLT1
SCHEMBL5242133 0.83 KDR (0.44) KDRFLT1RAB9A
SCHEMBL5838442 0.83 RAB9A (0.42) KDRFLT1TLR8TLR7RAB9A
SCHEMBL5838156 0.83 RAB9A (0.42) KDRFLT1TLR8TLR7RAB9A

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 12/4885KDM4E 1358/4885

“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.