SCHEMBL6768366

SCHEMBL6768366

FC(F)(F)c1nnc(-c2ccc3ncnc(Nc4ccc(OCc5ccccc5)cc4)c3c2)o1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.61
ERBB2 P04626 12/20 0.61
CHEK2 O96017 1/20 0.58
ROS1 P08922 1/20 0.58
FLT3 P36888 1/20 0.58
ERBB4 Q15303 1/20 0.58
AURKB Q96GD4 1/20 0.58
CLK4 Q9HAZ1 1/20 0.58
MKNK2 Q9HBH9 1/20 0.58
PDGFRB P09619 1/20 0.49
KDR P35968 1/20 0.49
PIK3CA P42336 1/20 0.48
PIK3CG P48736 1/20 0.48

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
SCHEMBL6766849 0.92 EGFR (0.50) EGFRERBB2CHEK2ROS1FLT3
SCHEMBL6764413 0.91 EGFR (0.57) EGFRERBB2PDGFRB
Hydrochloric Acid SCHEMBL6768794 0.91 EGFR (0.49) EGFRERBB2CHEK2ROS1FLT3
Hydrochloric Acid SCHEMBL6764193 0.91 EGFR (0.57) EGFRERBB2PDGFRB
SCHEMBL6768865 0.89 ERBB2 (0.46) EGFRERBB2CHEK2ROS1FLT3
Hydrochloric Acid SCHEMBL6764013 0.88 EGFR (0.46) EGFRERBB2CHEK2ROS1FLT3
SCHEMBL6767208 0.86 EGFR (0.66) EGFRERBB2CHEK2ROS1FLT3
Hydrochloric Acid SCHEMBL6766892 0.85 EGFR (0.64) EGFRERBB2CHEK2ROS1FLT3
SCHEMBL6767609 0.79 EGFR (0.53) EGFRERBB2CHEK2ROS1FLT3
SCHEMBL6764264 0.79 ERBB2 (0.61) EGFRERBB2ERBB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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

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 EGFR 354/4885ERBB2 35/4885CHEK2 86/4885

“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.