SCHEMBL810758

SCHEMBL810758

COc1ccccc1COc1ccc(Sc2ccc(O)cc2)c(Nc2ncnc3nc(C(C)(C)O)ccc23)c1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.65
AKT2 P31751 1/20 0.65
MAPT P10636 3/20 0.35
HTT P42858 2/20 0.35
MAPK1 P28482 2/20 0.35
GAA P10253 1/20 0.35
HSD17B10 Q99714 1/20 0.35
EGFR P00533 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
RET P07949 1/20 0.33
KDR P35968 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL809987 0.88 PIM1 (0.63) PIM1AKT2MAPTMEN1KMT2A
SCHEMBL810736 0.87 PIM1 (0.66) PIM1AKT2MAPTHTTMAPK1
SCHEMBL810583 0.86 PIM1 (0.64) PIM1AKT2MAPTHTTMAPK1
SCHEMBL810351 0.84 PIM1 (0.61) PIM1AKT2MAPTHTTEGFR
SCHEMBL811069 0.83 PIM1 (0.64) PIM1AKT2MAPTHTTEGFR
SCHEMBL810849 0.82 PIM1 (0.55) PIM1AKT2MAPTEGFRMEN1
SCHEMBL810073 0.81 PIM1 (0.55) PIM1AKT2MAPTEGFRMEN1
SCHEMBL810908 0.80 PIM1 (0.85) PIM1AKT2MAPTEGFRMEN1
SCHEMBL811263 0.79 PIM1 (0.82) PIM1AKT2MAPTMEN1KMT2A
SCHEMBL811393 0.79 PIM1 (1.00) PIM1AKT2MAPTEGFRMEN1

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 4 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
US-20070197558-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-08-23 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-20070197558-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 PIM1 2963/4885AKT2 3903/4885MAPT 1347/4885

“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.