SCHEMBL991202

SCHEMBL991202

CCOC(=O)Cc1c(Cl)ccc2ccc(OS(=O)(=O)C(F)(F)F)cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
PTGS2 P35354 1/20 0.39
HTR1A P08908 4/20 0.37
HTR1D P28221 4/20 0.37
HTR1B P28222 4/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 2/20 0.36
GAA P10253 2/20 0.36
POLB P06746 1/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 4/20 0.35
XBP1 P17861 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 3/20 0.35
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
THRB P10828 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ADORA1 P30542 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
SCHEMBL3588873 0.92 HSD11B1 (0.39) HSD11B1PTGS2HTR1AHTR1DHTR1B
SCHEMBL149845 0.82 ALDH1A1 (0.38) HSD11B1HTR1AHTR1DHTR1BKMT2A
SCHEMBL991313 0.82 PTGS2 (0.54) PTGS2HTR1AGAAKDM4EMAPT
SCHEMBL27729019 0.80 HSD11B1 (0.44) HSD11B1HTR1AHTR1DHTR1B
SCHEMBL27729245 0.78 HTR1D (0.41) HSD11B1HTR1AHTR1DHTR1BL3MBTL1
SCHEMBL991440 0.77 KDM4E (0.43) KMT2AMEN1GAAKDM4ELMNA
SCHEMBL989998 0.75 KDM4E (0.41) PTGS2KMT2AMEN1POLBKDM4E
SCHEMBL151254 0.74 MAPT (0.40) KMT2AMEN1POLBKDM4ELMNA
SCHEMBL3591326 0.74 PTGS2 (0.50) PTGS2HTR1AGAAKDM4ELMNA
SCHEMBL150626 0.73 HSD11B1 (0.38) HSD11B1HTR1AHTR1DHTR1BKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426440-B2 Indolymaleimide derivatives NOVARTIS AG (CH) 2013-04-23 US disclosed
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-2246346-B1 Indolylmaleimide derivatives as protein kinase inhibitors NOVARTIS AG (CH) 2012-10-24 EP disclosed
EP-1904482-B1 INDOLYLMALEIMIDE DERIVATIVES NOVARTIS AG (CH) 2011-01-19 EP disclosed
EP-2270001-A1 Indolylmaleimide derivatives as PKC inhibitors Novartis AG (CH) 2011-01-05 EP disclosed
EP-2246346-A1 Indolylmaleimide derivatives as protein kinase inhibitors Novartis AG (CH) 2010-11-03 EP disclosed
US-20100273774-A1 INDOLYMALEIMIDE DERIVATIVES WAGNER JUERGEN 2010-10-28 US disclosed
US-7781438-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2010-08-24 US disclosed
US-7648989-B2 Indolylmaleimide derivatives as PKC inhibitors NOVARTIS AG (CH) 2010-01-19 US disclosed
US-20080318975-A1 Indolylmaleimide Derivatives NOVARTIS AG (CH) 2008-12-25 US disclosed
US-20080242675-A1 Indolylmaleimide Derivatives as Pkc Inhibitors NOVARTIS AG (CH) 2008-10-02 US disclosed
EP-1904482-A2 INDOLYLMALEIMIDE DERIVATIVES Novartis AG (CH) 2008-04-02 EP disclosed
EP-1745037-A1 INDOLYLMALEIMIDE DERIVATIVES AS PKC INHIBITORS Novartis AG (CH) 2007-01-24 EP disclosed
WO-2007006533-A2 INDOLYLMALEIMIDE DERIVATIVES NOVARTIS AG (CH) 2007-01-18 WO 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 (3 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-20100273774-A1 INDOLYMALEIMIDE DERIVATIVES IDO1, INMT, IDO2 HSD11B1 251/4885PTGS2 1322/4885HTR1A 231/4885
US-20080242675-A1 Indolylmaleimide Derivatives as Pkc Inhibitors PRKCE, PRKCH, PRKCI HSD11B1 1471/4885PTGS2 1642/4885HTR1A 3106/4885
US-20080318975-A1 Indolylmaleimide Derivatives IDH3A, INMT, IDH3B HSD11B1 503/4885PTGS2 1300/4885HTR1A 1043/4885

“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.