SCHEMBL6189657

SCHEMBL6189657

COCC[n+]1c2c(n(Cc3ccc(F)cc3)c1C)C(=O)c1ccccc1C2=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.47
RIPK2 O43353 1/20 0.47
SP1 P08047 1/20 0.47
ILF3 Q12906 1/20 0.47
PAK1 Q13153 1/20 0.47
IDO1 P14902 2/20 0.41
TDO2 P48775 2/20 0.41
CASP3 P42574 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.37
GNRHR P30968 1/20 0.36
CYP2D6 P10635 1/20 0.36
HRH1 P35367 1/20 0.36
KCNH2 Q12809 1/20 0.36
TP53 P04637 1/20 0.36
LMNA P02545 3/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL6188964 0.90 BIRC5 (0.48) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6188763 0.85 BIRC5 (0.50) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6188546 0.83 BIRC5 (0.64) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6191838 0.83 BIRC5 (0.50) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6191592 0.82 BIRC5 (0.49) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6189591 0.80 BIRC5 (0.49) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6187056 0.80 BIRC5 (0.58) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6189328 0.79 BIRC5 (0.55) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6191935 0.79 BIRC5 (0.57) BIRC5RIPK2SP1ILF3PAK1
SCHEMBL6189812 0.79 BIRC5 (0.57) BIRC5RIPK2SP1ILF3PAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1256576-B1 FUSED IMIDAZOLIUM DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2005-06-15 EP claimed
US-6734203-B2 ANTI-CANCERS AND ANTITUMOR AGENTS ASTELLAS PHARMA INC. (JP) 2004-05-11 US claimed
US-20030114508-A1 Fused imidazolium derivatives ASTELLAS PHARMA INC. (JP) 2003-06-19 US claimed
EP-1256576-A1 FUSED IMIDAZOLIUM DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2002-11-13 EP claimed
EP-1256576-B1 FUSED IMIDAZOLIUM DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2005-06-15 EP disclosed
US-6734203-B2 ANTI-CANCERS AND ANTITUMOR AGENTS ASTELLAS PHARMA INC. (JP) 2004-05-11 US disclosed
US-20030114508-A1 Fused imidazolium derivatives ASTELLAS PHARMA INC. (JP) 2003-06-19 US disclosed
EP-1256576-A1 FUSED IMIDAZOLIUM DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2002-11-13 EP 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-20030114508-A1 Fused imidazolium derivatives TP53, HRAS, BCOR BIRC5 53/4885RIPK2 408/4885SP1 1868/4885

“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.