SCHEMBL6147993

SCHEMBL6147993

CC(C)(C)OC(=O)N1CCC(Cn2c(=O)[nH]c3cnccc32)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.50
NAMPT P43490 3/20 0.44
P2RX7 Q99572 2/20 0.43
PIK3CA P42336 1/20 0.43
PRKDC P78527 1/20 0.43
CYP2C9 P11712 1/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
BACE1 P56817 1/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL30336989 0.85 KDM4E (0.50) GPR119KDM4EMAPTTHRBPKM
SCHEMBL3634218 0.85 KDM4E (0.50) GPR119KDM4EMAPTTHRBPKM
SCHEMBL2247700 0.82 CCR5 (0.51) GPR119
SCHEMBL29492816 0.82 PARP1 (0.45) GPR119PIK3CAPRKDCKDM4EMAPT
SCHEMBL22724890 0.82 BRD3 (0.49) GPR119KDM4EMAPTTHRB
SCHEMBL6157116 0.79 GPR119 (0.48) GPR119P2RX7PIK3CAPRKDCKDM4E
SCHEMBL20450694 0.79 CCR5 (0.46) GPR119CYP2C9
SCHEMBL20450695 0.79 CCR5 (0.46) GPR119CYP2C9
SCHEMBL17796243 0.78 TSHR (0.64) GPR119KDM4EMAPTPKM
SCHEMBL6151980 0.77 GPR119 (0.47) GPR119P2RX7KDM4EPKM

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 789/4885NAMPT 293/4885P2RX7 431/4885

“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.