SCHEMBL5771855

SCHEMBL5771855

COc1ccc2c(Oc3ccc4c(C(=O)NC(C)C)cccc4c3)ccnc2c1

nearest known ligand 0.84

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.84
AURKA O14965 13/20 0.84
TEK Q02763 13/20 0.84
MET P08581 12/20 0.84
LCK P06239 10/20 0.84
AURKB Q96GD4 7/20 0.84
PDGFRA P16234 1/20 0.71
LYN P07948 3/20 0.62
ABL1 P00519 2/20 0.62
CYP3A4 P08684 2/20 0.62
FGR P09769 1/20 0.62
CYP2D6 P10635 1/20 0.62
FLT1 P17948 1/20 0.62

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
SCHEMBL5774867 0.90 KDR (0.83) KDRAURKATEKMETLCK
SCHEMBL2748969 0.86 KDR (0.82) KDRAURKATEKMETLCK
SCHEMBL2746823 0.86 KDR (0.84) KDRAURKATEKMETLCK
SCHEMBL4548966 0.85 KDR (1.00) KDRAURKATEKMETLCK
SCHEMBL2748242 0.85 KDR (0.80) KDRAURKATEKMETLCK
SCHEMBL2746887 0.85 KDR (1.00) KDRAURKATEKMETLCK
SCHEMBL5771857 0.85 KDR (0.86) KDRAURKATEKMETLCK
SCHEMBL2747800 0.85 KDR (1.00) KDRAURKATEKMETLCK
SCHEMBL5769862 0.84 KDR (0.83) KDRAURKATEKMETLCK
SCHEMBL2746919 0.84 KDR (1.00) KDRAURKATEKMETLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1660503-A1 NAPHTHALENE CARBOXAMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER INC. (US) 2006-05-31 EP disclosed
US-20050070508-A1 Napthalene carboxamides and their derivatives useful as new anti-angiogenic agents AGOURON PHARMACEUTICALS, INC. 2005-03-31 US disclosed
WO-2005021553-A1 NAPHTHALENE CARBOXAMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER INC. (US) 2005-03-10 WO 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 30/4885AURKA 2306/4885TEK 313/4885

“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.