SCHEMBL4023201

SCHEMBL4023201

CC(C)(C)OC(=O)NC1CCC(CN2CCN(Cc3ccccc3)CC2)C1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.60
KMT2A Q03164 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
DRD3 P35462 2/20 0.51
KDM1A O60341 1/20 0.47
MAOB P27338 1/20 0.47
SIGMAR1 Q99720 2/20 0.47
HTR1A P08908 1/20 0.47
KCNA3 P22001 1/20 0.47
MEN1 O00255 1/20 0.47
NPFFR1 Q9GZQ6 1/20 0.45
NPFFR2 Q9Y5X5 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
Trifluoroacetic Acid SCHEMBL3900549 0.95 DRD2 (0.56) DRD2KMT2AL3MBTL1DRD3KDM1A
SCHEMBL16449452 0.88 DRD2 (0.59) DRD2KMT2AL3MBTL1DRD3KDM1A
SCHEMBL3900542 0.87 DRD2 (0.62) DRD2KMT2AL3MBTL1DRD3KDM1A
SCHEMBL31313173 0.86 KMT2A (0.63) DRD2KMT2AL3MBTL1DRD3KDM1A
SCHEMBL915402 0.84 KMT2A (0.65) DRD2KMT2AL3MBTL1DRD3MAOB
SCHEMBL30135979 0.84 KMT2A (0.57) DRD2KMT2AL3MBTL1MAOBSIGMAR1
SCHEMBL23689558 0.83 KMT2A (0.61) DRD2KMT2AL3MBTL1DRD3KDM1A
SCHEMBL3897971 0.82 DRD2 (0.78) DRD2KMT2AL3MBTL1DRD3KDM1A
SCHEMBL31327073 0.82 KMT2A (0.67) DRD2KMT2AL3MBTL1DRD3KDM1A
SCHEMBL12731712 0.82 KMT2A (0.70) DRD2KMT2AL3MBTL1KDM1AMAOB

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
US-7538128-B2 Dipeptidyl peptidase IV inhibitors, process for their preparation and compositions containing them GLENMARK PHARMACEUTICALS S.A. (CH) 2009-05-26 US disclosed
US-7524844-B2 Dipeptidyl peptidase IV inhibitors, process for their preparation and compositions containing them GLENMARK PHARMACEUTICALS S.A. (CH) 2009-04-28 US disclosed
US-20070238728-A1 NOVEL DIPEPTIDYL PEPTIDASE IV INHIBITORS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS S.A. (CH) 2007-10-11 US disclosed
US-20070232608-A1 NOVEL DIPEPTIDYL PEPTIDASE IV INHIBITORS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS S.A. (CH) 2007-10-04 US disclosed
US-7205323-B2 Dipeptidyl peptidase IV inhibitors pharmaceutical compositions containing them, and process for their preparation GLENMARK PHARMACEUTICALS S.A. (CH) 2007-04-17 US disclosed
US-20060142585-A1 Novel dipeptidyl peptidase IV inhibitors pharmaceutical compositions containing them, and process for their preparation GLENMARK PHARMACETUCALS, S.A. 2006-06-29 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 (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-20060142585-A1 Novel dipeptidyl peptidase IV inhibitors pharmaceutical compositions containing them, and process for their preparation DPP4, DPP3, DPP7 DRD2 2892/4885KMT2A 3383/4885L3MBTL1 4421/4885
US-20070232608-A1 NOVEL DIPEPTIDYL PEPTIDASE IV INHIBITORS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM DPP4, DPP3, DPP7 DRD2 3063/4885KMT2A 3071/4885L3MBTL1 3722/4885
US-20070238728-A1 NOVEL DIPEPTIDYL PEPTIDASE IV INHIBITORS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM DPP4, DPP3, DPP7 DRD2 3063/4885KMT2A 3071/4885L3MBTL1 3722/4885

“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.