SCHEMBL16016709

SCHEMBL16016709

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1C

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.67
KDR P35968 4/20 0.65
EPHA2 P29317 3/20 0.65
EPHB4 P54760 3/20 0.65
ERBB2 P04626 3/20 0.65
FLT1 P17948 1/20 0.65
RET P07949 1/20 0.64
KIF5B P33176 1/20 0.64
KCNH2 Q12809 2/20 0.64
CYP2D6 P10635 1/20 0.61

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
SCHEMBL10100955 0.92 KDR (0.75) EGFRKDREPHA2EPHB4ERBB2
SCHEMBL28631617 0.88 EGFR (0.66) EGFRKDREPHA2EPHB4ERBB2
SCHEMBL29781309 0.88 EGFR (0.73) EGFRKDREPHA2EPHB4ERBB2
SCHEMBL29781300 0.88 EGFR (0.66) EGFRKDREPHA2EPHB4ERBB2
SCHEMBL202827 0.88 EGFR (0.73) EGFRKDREPHA2EPHB4ERBB2
SCHEMBL29988516 0.88 EGFR (0.66) EGFRKDREPHA2EPHB4ERBB2
SCHEMBL4448821 0.88 EGFR (0.66) EGFRKDREPHA2EPHB4ERBB2
SCHEMBL21541701 0.88 EGFR (0.66) EGFRKDREPHA2EPHB4ERBB2
Methane SCHEMBL5123634 0.87 EGFR (0.72) EGFRKDREPHA2EPHB4ERBB2
SCHEMBL16075706 0.87 EGFR (0.67) EGFRKDREPHA2EPHB4ERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 WO disclosed
US-20180016259-A1 QUINAZOLINE INHIBITORS OF ACTIVATING MUTANT FORMS OF EPIDERMAL GROWTH FACTOR RECEPTOR ASTRAZENECA AB (SE) 2018-01-18 US disclosed
US-9718806-B2 Quinazoline inhibitors of activating mutant forms of epidermal growth factor receptor ASTRAZENECA AB (SE) 2017-08-01 US disclosed
US-20160340342-A1 QUINAZOLINE INHIBITORS OF ACTIVATING MUTANT FORMS OF EPIDERMAL GROWTH FACTOR RECEPTOR ASTRAZENECA AB (SE) 2016-11-24 US disclosed
US-9375432-B2 Quinazoline inhibitors of activating mutant forms of epidermal growth factor receptor ASTRAZENECA AB (SE) 2016-06-28 US disclosed
US-20150320751-A1 Quinazoline Inhibitors of activating mutant forms of Epidermal Growth Factor Receptor ASTRAZENECA AB (SE) 2015-11-12 US disclosed
US-9066979-B2 Quinazoline inhibitors of activating mutant forms of epidermal growth factor receptor ASTRAZENECA AB (SE) 2015-06-30 US disclosed
US-20140255428-A1 Quinazoline Inhibitors of activating mutant forms of Epidermal Growth Factor Receptor ASTRAZENECA AB (SE) 2014-09-11 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 (4 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-20150320751-A1 Quinazoline Inhibitors of activating mutant forms of Epidermal Growth Factor Receptor EGFR, ABL1, ERBB2 EGFR 1/4885KDR 78/4885EPHA2 561/4885
US-20180016259-A1 QUINAZOLINE INHIBITORS OF ACTIVATING MUTANT FORMS OF EPIDERMAL GROWTH FACTOR RECEPTOR EGFR, ERBB2, ABL1 EGFR 1/4885KDR 63/4885EPHA2 670/4885
US-20160340342-A1 QUINAZOLINE INHIBITORS OF ACTIVATING MUTANT FORMS OF EPIDERMAL GROWTH FACTOR RECEPTOR EGFR, ABL1, ERBB2 EGFR 1/4885KDR 78/4885EPHA2 561/4885
US-20140255428-A1 Quinazoline Inhibitors of activating mutant forms of Epidermal Growth Factor Receptor EGFR, ERBB2, ABL1 EGFR 1/4885KDR 74/4885EPHA2 483/4885

“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.