SCHEMBL7522800

SCHEMBL7522800

CC(C)(C)OC(=O)N1CCC(COc2cncc(Br)c2)C1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.50
TDO2 P48775 1/20 0.50
GPR119 Q8TDV5 7/20 0.48
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
ALOX5AP P20292 2/20 0.45
FEN1 P39748 2/20 0.45
SLC2A1 P11166 1/20 0.45
CHEK2 O96017 2/20 0.44
SCN9A Q15858 1/20 0.42
HDAC1 Q13547 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 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
SCHEMBL28510099 0.94 GPR119 (0.50) IDO1TDO2GPR119CHRNB2CHRNA4
SCHEMBL29960962 0.94 GPR119 (0.50) IDO1TDO2GPR119CHRNB2CHRNA4
SCHEMBL7524187 0.83 GPR119 (0.49) IDO1TDO2GPR119ALOX5APFEN1
SCHEMBL7513551 0.83 GPR119 (0.49) IDO1TDO2GPR119ALOX5APFEN1
SCHEMBL7525477 0.83 GPR119 (0.49) IDO1TDO2GPR119ALOX5APFEN1
SCHEMBL21398088 0.83 GPR119 (0.53) IDO1TDO2GPR119ALOX5APFEN1
SCHEMBL26311640 0.83 GPR119 (0.53) IDO1TDO2GPR119ALOX5APFEN1
SCHEMBL7463050 0.81 PIK3CD (0.48) IDO1TDO2GPR119CHEK2
SCHEMBL7465754 0.81 PIK3CD (0.48) IDO1TDO2GPR119CHEK2
SCHEMBL14778459 0.81 PIK3CD (0.48) IDO1TDO2GPR119CHEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission LIN NAN-HORNG (US) 2002-10-17 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-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission GAP43, SLC18A2, GABRE IDO1 4137/4885TDO2 2266/4885GPR119 604/4885

“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.