SCHEMBL6768285

SCHEMBL6768285

COC(=O)c1ccc(-c2ccc3ncnc(Nc4ccc(OCc5ccccc5)cc4)c3c2)o1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 15/20 0.67
EGFR P00533 12/20 0.67
ERBB4 Q15303 2/20 0.58
CHEK2 O96017 1/20 0.58
ROS1 P08922 1/20 0.58
FLT3 P36888 1/20 0.58
AURKB Q96GD4 1/20 0.58
CLK4 Q9HAZ1 1/20 0.58
MKNK2 Q9HBH9 1/20 0.58
HDAC3 O15379 1/20 0.54
ABL1 P00519 1/20 0.54
INSR P06213 1/20 0.54
PDGFRB P09619 1/20 0.54
CDK2 P24941 1/20 0.54
PLK1 P53350 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54

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
SCHEMBL6763978 0.93 ERBB2 (0.66) ERBB2EGFRERBB4CHEK2ROS1
Hydrochloric Acid SCHEMBL6766485 0.92 ERBB2 (0.65) ERBB2EGFRERBB4CHEK2ROS1
SCHEMBL7505502 0.88 ERBB2 (0.63) ERBB2EGFRERBB4CHEK2ROS1
SCHEMBL16575227 0.87 ERBB2 (0.70) ERBB2EGFRERBB4CHEK2ROS1
SCHEMBL7506501 0.87 ERBB2 (0.64) ERBB2EGFRERBB4CHEK2ROS1
SCHEMBL6767139 0.86 ERBB2 (0.79) ERBB2EGFR
SCHEMBL2999764 0.85 ERBB2 (0.68) ERBB2EGFRERBB4CHEK2ROS1
SCHEMBL3320672 0.84 ERBB2 (0.70) ERBB2EGFRERBB4CHEK2ROS1
Hydrochloric Acid SCHEMBL3319025 0.84 ERBB2 (0.67) ERBB2EGFRERBB4CHEK2ROS1
SCHEMBL4005786 0.83 ERBB2 (0.68) ERBB2EGFRERBB4CHEK2ROS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912559-B1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LTD (GB) 2002-11-06 EP claimed
US-6391874-B1 ANTICARCINOGENIC AGENTS; SKIN DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-05-21 US claimed
EP-0912559-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-05-06 EP claimed
WO-1998002434-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-01-22 WO claimed
US-6828320-B2 Enzyme inhibitors; anticancer agents SMITHKLINE BEECHAM CORPORATION 2004-12-07 US disclosed
EP-0912559-B1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LTD (GB) 2002-11-06 EP disclosed
US-20020147214-A1 Heterocyclic compounds NOVARTIS AG (CH) 2002-10-10 US disclosed
US-6391874-B1 ANTICARCINOGENIC AGENTS; SKIN DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-05-21 US disclosed
EP-0912559-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-05-06 EP disclosed
WO-1998002434-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-01-22 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-20020147214-A1 Heterocyclic compounds BRAF, ABL1, CSK ERBB2 35/4885EGFR 354/4885ERBB4 141/4885

“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.