SCHEMBL991950

SCHEMBL991950

CCOC(=O)Cc1c(Cl)ccc2ccc(C#N)cc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
KDM4E B2RXH2 6/20 0.39
HSD17B10 Q99714 3/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C9 P11712 1/20 0.39
GPR35 Q9HC97 1/20 0.39
NCEH1 Q6PIU2 1/20 0.39
SLC34A1 Q06495 1/20 0.38
PDE5A O76074 1/20 0.38
L3MBTL1 Q9Y468 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 2/20 0.37
HCRTR2 O43614 1/20 0.37

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
SCHEMBL3588920 0.91 NCEH1 (0.46) ALOX15KDM4EHSD17B10LMNAALDH1A1
SCHEMBL991440 0.82 KDM4E (0.43) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL991313 0.80 PTGS2 (0.54) KDM4EHSD17B10ALDH1A1HPGDL3MBTL1
SCHEMBL989998 0.80 KDM4E (0.41) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL16110186 0.78 PDCD1 (0.43) ALOX15KDM4EALDH1A1PDCD1CD274
SCHEMBL989779 0.77 CYP4F2 (0.40) ALOX15KDM4EHSD17B10LMNAALDH1A1
SCHEMBL3586690 0.75 KDM4E (0.42) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL9936524 0.75 MEN1 (0.49) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL3600465 0.75 ALDH1A1 (0.46) ALOX15KDM4EHSD17B10LMNAALDH1A1
Dimethylamine SCHEMBL5206984 0.74 KDM4E (0.39) ALOX15KDM4ELMNAALDH1A1L3MBTL1

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 ALOX15 3702/4885KDM4E 1638/4885HSD17B10 1029/4885
US-20080242675-A1 Indolylmaleimide Derivatives as Pkc Inhibitors PRKCE, PRKCH, PRKCI ALOX15 4527/4885KDM4E 441/4885HSD17B10 2212/4885
US-20080318975-A1 Indolylmaleimide Derivatives IDH3A, INMT, IDH3B ALOX15 4406/4885KDM4E 207/4885HSD17B10 443/4885

“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.