SCHEMBL6795808

SCHEMBL6795808

COCC1Oc2cc3ncnc(Cl)c3cc2OC1COC

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.60
ENPP1 P22413 3/20 0.46
ADK P55263 1/20 0.35
SELE P16581 1/20 0.34
VCAM1 P19320 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
ALDH1A1 P00352 1/20 0.32
RIPK2 O43353 1/20 0.31
SRC P12931 1/20 0.31
NOD1 Q9Y239 1/20 0.31
FLT1 P17948 2/20 0.31
KDR P35968 2/20 0.31
FGFR1 P11362 1/20 0.30

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
SCHEMBL6801304 0.83 EGFR (0.54) EGFR
SCHEMBL6795035 0.82 EGFR (0.43) EGFRENPP1
SCHEMBL12201513 0.79 ENPP1 (0.42) EGFRENPP1SELEVCAM1PDE4A
SCHEMBL6794722 0.76 EGFR (1.00) EGFRALDH1A1SRC
SCHEMBL6795102 0.71 EGFR (1.00) EGFRSRCKDRFGFR1
SCHEMBL367950 0.68 PDE5A (0.48) EGFRENPP1PDE4APDE4BPDE4C
SCHEMBL29589537 0.68 PDE5A (0.48) EGFRENPP1PDE4APDE4BPDE4C
SCHEMBL31004058 0.68 EGFR (0.52) EGFRSRCFGFR1
SCHEMBL1012990 0.68 EGFR (0.52) EGFRSRCFGFR1
Hydrochloric Acid SCHEMBL8808443 0.67 PDE5A (0.47) EGFRENPP1PDE4APDE4BPDE4C

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-6835735-B2 Anticancer, tyrosine kinase inhibitors KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2004-12-28 US disclosed
US-20030045537-A1 4-(Phenylamino)-[1,4]dioxano[2,3-g]quinazoline derivatives and process for preparing the same KOREAN INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2003-03-06 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-20030045537-A1 4-(Phenylamino)-[1,4]dioxano[2,3-g]quinazoline derivatives and process for preparing the same EGFR, ERBB2, ERBB4 EGFR 1/4885ENPP1 1539/4885ADK 684/4885

“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.