SCHEMBL6148208

SCHEMBL6148208

CC(C)(C)OC(=O)N1CCC(C(N)C(=O)Oc2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.53
USP30 Q70CQ3 1/20 0.51
GAA P10253 1/20 0.50
DPP4 P27487 2/20 0.48
KDM4E B2RXH2 1/20 0.48
PKM P14618 1/20 0.48
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
STS P08842 1/20 0.46
MMP13 P45452 2/20 0.46
MMP1 P03956 1/20 0.46
IDO1 P14902 3/20 0.45

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
SCHEMBL30702475 0.80 GPR119 (0.57) GPR119DPP4KDM4EPKMNPC1
SCHEMBL2553057 0.80 GPR119 (0.57) GPR119DPP4KDM4EPKMNPC1
SCHEMBL20615705 0.80 GPR119 (0.57) GPR119DPP4KDM4EPKMNPC1
SCHEMBL24621773 0.80 GPR119 (0.60) GPR119KDM4EPKMNPC1ALDH1A1
SCHEMBL3640119 0.79 DPP4 (0.53) GPR119DPP4NPC1ALDH1A1MAPT
SCHEMBL903630 0.79 DPP4 (0.53) GPR119DPP4NPC1ALDH1A1MAPT
SCHEMBL8749527 0.79 DPP4 (0.55) GPR119DPP4NPC1ALDH1A1MAPT
SCHEMBL1770352 0.79 DPP4 (0.55) GPR119DPP4NPC1ALDH1A1MAPT
SCHEMBL1440781 0.79 DPP4 (0.55) GPR119DPP4NPC1ALDH1A1MAPT
SCHEMBL27446359 0.78 DPP4 (0.52) GPR119GAADPP4NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143391-A1 Heterocyclic amides with alpha-4 integrin antagonist activity J. Uriach Y Compañia S.A. (ES) 2005-06-30 US disclosed
EP-1495044-A1 HETEROCYCLIC AMIDES WITH ALPHA-4 INTEGRIN ANTAGONIST ACTIVITY J. Uriach y Compania S.A. (ES) 2005-01-12 EP disclosed
WO-2003084984-A1 HETEROCYCLIC AMIDES WITH ALPHA-4 INTEGRIN ANTAGONIST ACTIVITY J. URIACH Y COMPANIA S.A. (ES) 2003-10-16 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-20050143391-A1 Heterocyclic amides with alpha-4 integrin antagonist activity ITGB4, ITGA4, ITGA1 GPR119 789/4885USP30 4744/4885GAA 2218/4885

“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.