SCHEMBL6796326

SCHEMBL6796326

COCC1Oc2cc3ncnc(Nc4cccc(C#C[Si](C)(C)C)c4)c3cc2OC1COC

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.71
ABCG2 Q9UNQ0 2/20 0.53
GAK O14976 3/20 0.51
FBP1 P09467 2/20 0.51
ALDH1A1 P00352 1/20 0.51
MAPT P10636 1/20 0.51
RET P07949 4/20 0.49
KDR P35968 4/20 0.49
ERBB2 P04626 2/20 0.49
RIPK2 O43353 2/20 0.49
BUB1 O43683 2/20 0.49
STK10 O94804 2/20 0.49
MAP3K1 Q13233 2/20 0.49
PIP4K2C Q8TBX8 2/20 0.49
SLK Q9H2G2 2/20 0.49
SRC P12931 2/20 0.49
FLT1 P17948 2/20 0.49
CDK2 P24941 2/20 0.49
PLK4 O00444 1/20 0.49
CIT O14578 1/20 0.49

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
SCHEMBL6794863 0.89 EGFR (0.74) EGFRABCG2GAKFBP1ALDH1A1
SCHEMBL6794722 0.83 EGFR (1.00) EGFRFBP1ALDH1A1MAPTERBB2
SCHEMBL6794377 0.83 EGFR (0.78) EGFRABCG2GAKFBP1MAPT
SCHEMBL6795102 0.83 EGFR (1.00) EGFRFBP1KDRERBB2SRC
SCHEMBL7702775 0.80 EGFR (0.76) EGFRABCG2GAKFBP1ALDH1A1
Hydrochloric Acid SCHEMBL7708472 0.79 EGFR (0.77) EGFRABCG2GAKFBP1ALDH1A1
SCHEMBL22367380 0.77 EGFR (0.66) EGFRABCG2GAKFBP1ALDH1A1
SCHEMBL17845926 0.75 MAPK1 (0.65) EGFRABCG2GAKFBP1MAPT
SCHEMBL13285619 0.74 EGFR (0.72) EGFRABCG2GAKFBP1ALDH1A1
SCHEMBL6792872 0.71 EGFR (0.76) EGFRFBP1ALDH1A1MAPTKDR

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 1/4885ABCG2 155/4885GAK 39/4885

“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.