SCHEMBL810693

SCHEMBL810693

Cc1ccc(Sc2ccc(O)cc2)c(Nc2ncnc3ncccc23)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.52
AKT2 P31751 1/20 0.52
EGFR P00533 2/20 0.41
TNNI3K Q59H18 1/20 0.40
PIP4K2A P48426 1/20 0.37
PIP4K2C Q8TBX8 1/20 0.37
HSD17B10 Q99714 1/20 0.36
GAA P10253 3/20 0.35
NCOA1 Q15788 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
ABCG2 Q9UNQ0 3/20 0.35
HTT P42858 2/20 0.35
FGFR1 P11362 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RET P07949 1/20 0.34
KIF5B P33176 1/20 0.34
KDR P35968 1/20 0.34

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
SCHEMBL1455526 0.91 PIM1 (0.51) PIM1AKT2EGFRTNNI3KGAA
SCHEMBL810196 0.90 PIM1 (0.44) PIM1AKT2EGFRTNNI3KPIP4K2A
SCHEMBL810344 0.87 PIM1 (0.59) PIM1AKT2EGFRTNNI3KABCG2
SCHEMBL810229 0.86 KDM4E (0.42) PIM1AKT2EGFRTNNI3KPIP4K2A
SCHEMBL2960946 0.86 RIPK2 (0.41) PIM1AKT2GAAHTTKDM4E
SCHEMBL810060 0.85 PIM1 (0.58) PIM1AKT2EGFRTNNI3KABCG2
SCHEMBL811431 0.85 PIM1 (0.66) PIM1AKT2EGFRHSD17B10GAA
SCHEMBL811423 0.83 PIM1 (0.57) PIM1AKT2HTTFGFR1KDM4E
SCHEMBL811049 0.82 PIM1 (0.54) PIM1AKT2TNNI3KHSD17B10GAA
SCHEMBL810438 0.82 PIM1 (0.68) PIM1AKT2EGFRTNNI3KABCG2

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
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
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 PIM1 2963/4885AKT2 3903/4885EGFR 2701/4885

“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.