SCHEMBL810883

SCHEMBL810883

CC(C)c1ccc2c(Nc3cccc(OCc4cccc(Br)c4)c3)ncnc2n1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.54
MAOB P27338 2/20 0.44
FBP1 P09467 3/20 0.44
EPHB2 P29323 1/20 0.42
ERBB2 P04626 1/20 0.42
ERBB4 Q15303 1/20 0.42

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
SCHEMBL810328 0.90 EGFR (0.46) EGFRERBB2ERBB4
SCHEMBL810672 0.90 EGFR (0.49) EGFRERBB2
SCHEMBL810793 0.89 EGFR (0.46) EGFRMAOBFBP1ERBB2
SCHEMBL810369 0.87 EGFR (0.46) EGFRFBP1
SCHEMBL810221 0.86 EGFR (0.44) EGFRMAOB
SCHEMBL810367 0.83 EGFR (0.57) EGFRMAOBFBP1EPHB2
SCHEMBL811418 0.83 PIM1 (0.45) EGFRMAOB
SCHEMBL810694 0.80 PIM1 (0.61) EGFRMAOB
SCHEMBL810232 0.78 PIM1 (0.57) EGFR
SCHEMBL810419 0.76 EGFR (0.48) EGFRMAOBFBP1ERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1971611-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2012-10-10 EP disclosed
EP-2345652-A1 Antiviral compounds Abbott Laboratories (US) 2011-07-20 EP disclosed
US-7915411-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2011-03-29 US disclosed
CN-101443334-A Anti-viral compounds ABBOTT LAB (US) 2009-05-27 CN disclosed
EP-1971611-A1 ANTI-VIRAL COMPOUNDS Abbott Laboratories (US) 2008-09-24 EP disclosed
US-20070197558-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-08-23 US disclosed
WO-2007081517-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2007-07-19 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-20070197558-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 EGFR 2701/4885MAOB 3352/4885FBP1 2368/4885

“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.