SCHEMBL990666

SCHEMBL990666

COC(=O)Cc1cc(N2CCN(C)CC2)cnc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 4/20 0.46
MET P08581 7/20 0.43
MAPT P10636 3/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTR6 P50406 1/20 0.39
KCNH2 Q12809 1/20 0.39
PDGFRB P09619 1/20 0.38
FGFR1 P11362 1/20 0.38
PDGFRA P16234 1/20 0.38
FLT1 P17948 1/20 0.38
FGFR3 P22607 1/20 0.38
KDR P35968 1/20 0.38

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
SCHEMBL989799 0.86 SIRT6 (0.41) SIRT6METMAPTLMNAALDH1A1
SCHEMBL27678434 0.82 MET (0.43) SIRT6METMAPTLMNAPOLB
SCHEMBL24073869 0.77 SIRT6 (0.60) SIRT6METMAPTLMNAALDH1A1
SCHEMBL990747 0.75 MAPT (0.45) MAPTLMNAPOLBALDH1A1L3MBTL1
SCHEMBL26655887 0.72 ALDH1A1 (0.55) LMNAPOLBALDH1A1
SCHEMBL6522223 0.70 HTR3A (0.53) METMAPTLMNAALDH1A1HTR6
SCHEMBL4081314 0.70 RAB9A (0.41) SIRT6MAPTLMNAALDH1A1MAPK1
SCHEMBL13405746 0.68 ALDH1A1 (0.48) SIRT6METMAPTLMNAALDH1A1
SCHEMBL3550715 0.68 SIRT6 (0.57) SIRT6MAPTLMNAPOLBALDH1A1
SCHEMBL2256754 0.67 SIRT6 (0.52) SIRT6METMAPTLMNAALDH1A1

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-1745037-B1 Indolylmaleimide derivatives as inhibitors for the treatment of graft rejection or autoimmune diseases NOVARTIS AG (CH) 2013-01-02 EP disclosed
EP-2270001-A1 Indolylmaleimide derivatives as PKC inhibitors Novartis AG (CH) 2011-01-05 EP disclosed
US-7648989-B2 Indolylmaleimide derivatives as PKC inhibitors NOVARTIS AG (CH) 2010-01-19 US disclosed
US-20080242675-A1 Indolylmaleimide Derivatives as Pkc Inhibitors NOVARTIS AG (CH) 2008-10-02 US disclosed
EP-1745037-A1 INDOLYLMALEIMIDE DERIVATIVES AS PKC INHIBITORS Novartis AG (CH) 2007-01-24 EP disclosed
WO-2005068455-A1 INDOLYLMALEIMDE DERIVATIVES AS PKC INHIBITORS NOVARTIS AG (CH) 2005-07-28 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-20080242675-A1 Indolylmaleimide Derivatives as Pkc Inhibitors PRKCE, PRKCH, PRKCI SIRT6 1801/4885MET 2767/4885MAPT 3424/4885

“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.