SCHEMBL990673

SCHEMBL990673

CCOC(=O)Cc1cc(N2CCN(C)CC2)ncc1N

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HTR3A P46098 1/20 0.39
MAPK10 P53779 1/20 0.39
IKBKB O14920 1/20 0.39
DPP4 P27487 2/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HRH4 Q9H3N8 2/20 0.38
HRH3 Q9Y5N1 1/20 0.38
SMO Q99835 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC2 Q92769 1/20 0.37
PIK3CA P42336 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
SCHEMBL990802 0.86 SMO (0.47) AKT1SMN1; SMN2MEN1KMT2AHTR3A
SCHEMBL990764 0.82 MAPT (0.45) AKT1SMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL22652074 0.82 HTR3A (0.49) HTR3AHRH4HRH3
SCHEMBL27658351 0.79 HRH4 (0.40) HTR3AIKBKBRAB9AL3MBTL1HRH4
SCHEMBL3557669 0.78 MAPT (0.49) SMN1; SMN2MEN1KMT2AALDH1A1HRH3
SCHEMBL27678428 0.75 HTR3A (0.48) HTR3AHRH4HRH3
SCHEMBL989988 0.74 HTR3A (0.39) HTR3ARAB9AL3MBTL1HRH4HRH3
SCHEMBL992615 0.74 HTR3A (0.43) HTR3AIKBKBRAB9AL3MBTL1HRH4
SCHEMBL14938526 0.72 HTR3A (0.53) KMT2AHTR3AHRH4HRH3
SCHEMBL29464176 0.72 HTR3A (0.53) KMT2AHTR3AHRH4HRH3

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 AKT1 248/4885SMN1; SMN2 4485/4885MEN1 2291/4885

“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.