SCHEMBL6031474

SCHEMBL6031474

COc1cc2c(cc1OCc1ccccc1)NC(=O)NC2

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.50
KDR P35968 1/20 0.50
CHRNA7 P36544 2/20 0.49
PDE3B Q13370 1/20 0.48
PDE3A Q14432 1/20 0.48
PDE4B Q07343 2/20 0.47
PDE4A P27815 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
CTSV O60911 2/20 0.47
CTSL P07711 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SIRT2 Q8IXJ6 1/20 0.45
SRD5A1 P18405 1/20 0.45
SRD5A2 P31213 1/20 0.45
CISD1 Q9NZ45 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
SCHEMBL2836782 0.83 PDE3B (0.61) EGFRKDRPDE3BPDE3AKMT2A
SCHEMBL3056405 0.81 MAOA (0.62) CHRNA7PDE4BPDE4APDE4CPDE4D
SCHEMBL16537757 0.81 PDE4A (0.53) CHRNA7PDE4BPDE4APDE4CPDE4D
SCHEMBL16536586 0.81 PDE4A (0.53) CHRNA7PDE4BPDE4APDE4CPDE4D
SCHEMBL3041636 0.80 MAOA (0.53) CHRNA7PDE4BPDE4APDE4CPDE4D
SCHEMBL28355190 0.77 MAOB (0.66) PDE3BPDE3A
SCHEMBL5762667 0.76 CHRNA7 (0.55) CHRNA7PDE4BPDE4APDE4CPDE4D
SCHEMBL5415772 0.76 MEN1 (0.44) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL3055592 0.73 CHRNA7 (0.52) CHRNA7PDE4BPDE4APDE4CPDE4D
SCHEMBL6881236 0.73 PDE3B (0.45) PDE3BPDE3A

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
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB 2006-01-05 US disclosed
US-6939866-B2 Quinazoline derivatives ASTRAZENECA AB (SE) 2005-09-06 US disclosed
US-20040044015-A1 Quinazoline derivatives ASTRAZENECA AB (SE) 2004-03-04 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 (2 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-20040044015-A1 Quinazoline derivatives NQO2, NRAS, TOP1 EGFR 1832/4885KDR 2216/4885CHRNA7 2321/4885
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors FLT4, NOS3, FLT1 EGFR 549/4885KDR 4/4885CHRNA7 1038/4885

“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.