SCHEMBL6187944

SCHEMBL6187944

Cc1cccc(Nc2ncnc3ccc(-c4ccccc4)cc23)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 5/20 0.73
RAF1 P04049 5/20 0.73
EGFR P00533 7/20 0.71
MAPK1 P28482 4/20 0.70
ERBB2 P04626 2/20 0.70
HIF1A Q16665 3/20 0.70
HTT P42858 2/20 0.70
KDM4E B2RXH2 1/20 0.69
CD38 P28907 1/20 0.68
LMNA P02545 3/20 0.67
CYP1A2 P05177 3/20 0.67
CYP3A4 P08684 3/20 0.67
MEN1 O00255 2/20 0.67
USP2 O75604 2/20 0.67
TSHR P16473 2/20 0.67
CYP2C19 P33261 2/20 0.67
KMT2A Q03164 2/20 0.67
CLK4 Q9HAZ1 2/20 0.67
CYP2C9 P11712 1/20 0.67
HSD17B10 Q99714 1/20 0.67

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
SCHEMBL13620922 0.90 EGFR (0.67) BRAFRAF1EGFRMAPK1ERBB2
SCHEMBL15051337 0.88 BRAF (0.84) BRAFRAF1EGFRMAPK1ERBB2
SCHEMBL8871863 0.86 EGFR (0.82) EGFRMAPK1ERBB2HIF1AHTT
SCHEMBL4738594 0.85 EGFR (0.76) BRAFRAF1EGFRMAPK1ERBB2
SCHEMBL15052022 0.85 BRAF (1.00) BRAFRAF1MAPK1HIF1AHTT
SCHEMBL3391554 0.84 EGFR (1.00) EGFRMAPK1ERBB2HIF1AHTT
SCHEMBL4349199 0.83 MAPK1 (1.00) EGFRMAPK1ERBB2HIF1AHTT
SCHEMBL29350058 0.83 EGFR (1.00) EGFRMAPK1ERBB2HIF1AHTT
SCHEMBL159209 0.83 EGFR (1.00) EGFRMAPK1ERBB2HIF1AHTT
SCHEMBL15077870 0.82 RAF1 (0.84) BRAFRAF1EGFRMAPK1ERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0880507-B1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2005-04-13 EP claimed
CN-1142919-C Quinazoline derivatives as antitumor agents 2004-03-24 CN claimed
US-20030018029-A1 Quinazoline derivatives ZENECA LIMITED 2003-01-23 US claimed
US-6399602-B1 ANTICANCER AGENTS ZENECA LIMITED (GB) 2002-06-04 US claimed
CN-1211240-A Quinazoline derivatives as antitumor agents ZENECA LTD (GB) 1999-03-17 CN claimed
EP-0880507-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1998-12-02 EP claimed
WO-1997030034-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1997-08-21 WO claimed
US-6897214-B2 Quinazoline derivatives ZENECA LIMITED (GB) 2005-05-24 US disclosed
EP-0880507-B1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2005-04-13 EP disclosed
CN-1142919-C Quinazoline derivatives as antitumor agents 2004-03-24 CN disclosed
US-20030018029-A1 Quinazoline derivatives ZENECA LIMITED 2003-01-23 US disclosed
US-6399602-B1 ANTICANCER AGENTS ZENECA LIMITED (GB) 2002-06-04 US disclosed
CN-1211240-A Quinazoline derivatives as antitumor agents ZENECA LTD (GB) 1999-03-17 CN disclosed
US-5866572-A RECEPTOR TYROSINE KINASE INHIBITORY PROPERTIES, TREATMENT OF PROLIFERATIVE DISEASES SUCH AS CANCER. ZENECA LIMITED (GB) 1999-02-02 US disclosed
EP-0880507-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1998-12-02 EP disclosed
WO-1997030034-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1997-08-21 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-20030018029-A1 Quinazoline derivatives ABL1, FGFR1, ERBB2 BRAF 53/4885RAF1 7/4885EGFR 25/4885

“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.