SCHEMBL1455683

SCHEMBL1455683

Nc1ccc(Sc2ccc(C(=O)Nc3cccc(Br)c3)cc2Nc2ncnc3ncccc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.54
PDGFRB P09619 2/20 0.42
KIT P10721 1/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
ERBB2 P04626 3/20 0.42
ERBB4 Q15303 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
AURKA O14965 2/20 0.41
RPS6KB1 P23443 1/20 0.41
HDAC3 O15379 1/20 0.41
ABL1 P00519 1/20 0.41
CDK2 P24941 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41

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
SCHEMBL1455530 0.89 EGFR (0.52) EGFRPDGFRBKITFLT1FLT4
SCHEMBL1455867 0.88 PIM1 (0.50) EGFRKDRERBB2ERBB4ABCG2
SCHEMBL1454188 0.86 EGFR (0.46) EGFRPDGFRBKITFLT1FLT4
SCHEMBL1454779 0.86 EGFR (0.45) EGFRERBB2ERBB4ABCG2
SCHEMBL1454908 0.86 EGFR (0.48) EGFRPDGFRBKITFLT1FLT4
SCHEMBL1454780 0.84 PIM1 (0.45) EGFRKDRAURKAABL1AURKB
SCHEMBL1454720 0.83 PIM1 (0.44) EGFRKDRABCG2AURKAAURKB
SCHEMBL1454672 0.83 BRAF (0.48) EGFRKDRABCG2AURKAABL1
SCHEMBL1454907 0.83 PIM1 (0.45) EGFRKDRAURKARPS6KB1AURKB
SCHEMBL1454236 0.82 PIM1 (0.50) EGFRERBB2ERBB4ABCG2AURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1979348-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2012-01-18 EP disclosed
US-7910595-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2011-03-22 US disclosed
US-20070232627-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 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-20070232627-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 EGFR 2701/4885PDGFRB 1974/4885KIT 4434/4885

“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.