SCHEMBL1064740

SCHEMBL1064740

CCOC(=O)C(CC1CCC1)N=C(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
AAK1 Q2M2I8 1/20 0.43
NPC1 O15118 1/20 0.43
SLC6A2 P23975 3/20 0.40
SLC6A3 Q01959 3/20 0.40
SLC6A4 P31645 2/20 0.40
TSHR P16473 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
PIN1 Q13526 1/20 0.38
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
CTSD P07339 1/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL28269203 0.95 MEN1 (0.44) MEN1KMT2AAAK1NPC1SLC6A2
SCHEMBL25319859 0.85 AAK1 (0.61) MEN1KMT2AAAK1SLC6A4L3MBTL1
SCHEMBL25383775 0.83 AAK1 (0.52) MEN1KMT2AAAK1NPC1SLC6A2
SCHEMBL2652864 0.81 AAK1 (0.60) MEN1KMT2AAAK1SLC6A4CTSL
SCHEMBL2652706 0.81 AAK1 (0.60) MEN1KMT2AAAK1SLC6A4CTSL
SCHEMBL8633953 0.81 SMN1; SMN2 (0.51) MEN1KMT2ANPC1L3MBTL1SMN1; SMN2
SCHEMBL28643848 0.81 KDM4E (0.54) MEN1KMT2AAAK1
SCHEMBL5928301 0.81 MEN1 (0.51) MEN1KMT2AAAK1NPC1TSHR
SCHEMBL14493754 0.78 AAK1 (0.54) MEN1KMT2AAAK1NPC1SLC6A2
SCHEMBL1224951 0.77 AAK1 (0.46) MEN1KMT2AAAK1NPC1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2274297-B1 PYRROLIDINONE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2012-05-09 EP disclosed
EP-2274297-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2011-01-19 EP disclosed
US-7741327-B2 Pyrrolidinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2010-06-22 US disclosed
US-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
WO-2009127546-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2009-10-22 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-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS GCKR, GCK, PDK2 MEN1 2997/4885KMT2A 2072/4885AAK1 247/4885

“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.