SCHEMBL7408557

SCHEMBL7408557

CC(C)(C)OC(=O)N1CC[C@H]1COc1ccc(C#N)nc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.48
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
CHRNA3 P32297 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40

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
SCHEMBL7407720 0.86 CHRNB2 (0.53) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7479360 0.85 CHRNB2 (0.46) GPR119ALOX5APFEN1CHRNA3
SCHEMBL18291358 0.85 ALOX5AP (0.50) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7472876 0.85 CHRNA3 (0.59) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7472930 0.85 CHRNB2 (0.54) GPR119ALOX5APFEN1CHRNA3
SCHEMBL6588716 0.85 CHRNA3 (0.59) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7455050 0.84 GPR119 (0.42) GPR119ALOX5APFEN1CHRNA3
SCHEMBL6585750 0.83 GPR119 (0.41) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7481577 0.83 ALOX5AP (0.44) GPR119ALOX5APFEN1CHRNA3
SCHEMBL6585098 0.81 RET (0.40) GPR119ALOX5APFEN1

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
EP-0950057-B1 3-PYRIDYL ENANTIOMERS AND THEIR USE AS ANALGESICS ABBOTT LAB (US) 2002-11-13 EP disclosed
US-6403575-B1 ANTI-INFLAMMATORIES ABBOTT LABORATORIES 2002-06-11 US disclosed
EP-0846114-B1 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LAB (US) 2001-12-05 EP disclosed
EP-1047690-A1 HETEROCYCLIC ETHER AND THIOETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION Abbott Laboratories (US) 2000-11-02 EP disclosed
US-6133253-A NEURONAL CELL DEATH PREVENTORS AND ANTI-INFLAMMATORIES ABBOTT LABORATORIES (US) 2000-10-17 US disclosed
WO-1999032480-A1 HETEROCYCLIC ETHER AND THIOETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LABORATORIES (US) 1999-07-01 WO disclosed