SCHEMBL11930002

SCHEMBL11930002

CC(C)N1CC(=O)N(C(C)(C)C)C(=O)C1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.33
PTK2 Q05397 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
TOP2A P11388 1/20 0.32
TOP2B Q02880 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL14959575 0.73 SMN1; SMN2 (0.37) EGFRPTK2ALDH1A1MAPTTOP2A
SCHEMBL12534603 0.73 ALDH1A1 (0.36) EGFRPTK2ALDH1A1MAPTTOP2A
SCHEMBL11930011 0.73 KDM4E (0.32) GAATHRBL3MBTL1KDM4E
SCHEMBL13698407 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL27288786 0.72 ALDH1A1 (0.33) ALDH1A1GAATHRBL3MBTL1
SCHEMBL22017933 0.71 MAPT (0.34) EGFRPTK2ALDH1A1MAPTTOP2A
SCHEMBL23373020 0.71 CHRNB2 (0.36)
SCHEMBL2754568 0.69 LMNA (0.33) MAPTGAATHRBL3MBTL1KDM4E
SCHEMBL11930020 0.68 POLB (0.32) ALDH1A1
SCHEMBL12187921 0.68 F2 (0.40) EGFRPTK2ALDH1A1MAPTTOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2013-06-13 US disclosed
US-8445527-B2 Organic compounds and their uses NOVARTIS AG (CH) 2013-05-21 US disclosed
US-20120231998-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2012-09-13 US disclosed
US-8211932-B2 Organic compounds and their uses NOVARTIS AG (CH) 2012-07-03 US disclosed
US-8211932-B2 Organic compounds and their uses NOVARTIS AG (CH) 2012-07-03 US disclosed
US-20100331243-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-12-30 US disclosed
US-20100331243-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-12-30 US disclosed
US-7825152-B2 serine protease inhibitors, for the treatment of hepatitis c virus infections NOVARTIS AG (CH) 2010-11-02 US disclosed
US-20100204159-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-08-12 US disclosed
US-20070286842-A1 Organic Compounds and Their Uses NOVARTIS AG (CH) 2007-12-13 US disclosed
US-20070286842-A1 Organic Compounds and Their Uses NOVARTIS AG (CH) 2007-12-13 US 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 (5 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-20100331243-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 EGFR 4188/4885PTK2 3800/4885ALDH1A1 135/4885
US-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, HAVCR2, CPT1A EGFR 4237/4885PTK2 4647/4885ALDH1A1 153/4885
US-20070286842-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 EGFR 4188/4885PTK2 3800/4885ALDH1A1 135/4885
US-20100204159-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 EGFR 4188/4885PTK2 3800/4885ALDH1A1 135/4885
US-20120231998-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 EGFR 4188/4885PTK2 3800/4885ALDH1A1 135/4885

“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.