SCHEMBL1636802

SCHEMBL1636802

COc1ccc(N2CC(C(=O)OC(C)(C)C)N(C)C2=O)cn1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 9/20 0.55
PIK3CA P42336 3/20 0.40
DPP4 P27487 1/20 0.40
GPR119 Q8TDV5 1/20 0.39
PDK2 Q15119 1/20 0.38
OPRM1 P35372 1/20 0.37
OPRL1 P41146 1/20 0.37
CHRNB2 P17787 3/20 0.37
CHRNA4 P43681 3/20 0.37
CHRNB4 P30926 2/20 0.36
CHRNA3 P32297 2/20 0.36

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
SCHEMBL1637480 0.86 P2RX7 (0.53) P2RX7
SCHEMBL1636103 0.85 P2RX7 (0.53) P2RX7
SCHEMBL1638008 0.85 P2RX7 (0.60) P2RX7DPP4PDK2OPRM1OPRL1
SCHEMBL1636108 0.79 P2RX7 (0.56) P2RX7
SCHEMBL1637704 0.79 P2RX7 (0.48) P2RX7GPR119
SCHEMBL1636701 0.75 P2RX7 (0.47) P2RX7GPR119
SCHEMBL1635930 0.74 P2RX7 (0.50) P2RX7
SCHEMBL1636704 0.74 P2RX7 (0.49) P2RX7GPR119
SCHEMBL1636761 0.74 P2RX7 (0.51) P2RX7GPR119
SCHEMBL1636703 0.73 P2RX7 (0.49) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932282-B2 Imidazolidine carboxamide derivatives as P2X7 modulators GLAXO GROUP LIMITED (GB) 2011-04-26 US disclosed
US-20100075968-A1 Imidazolidine Carboxamide Derivatives as P2X7 Modulators GLAXO GROUP LIMITED (GB) 2010-03-25 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 (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-20100075968-A1 Imidazolidine Carboxamide Derivatives as P2X7 Modulators P2RX3, P2RX7, P2RX5 P2RX7 2/4885PIK3CA 397/4885DPP4 617/4885

“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.