SCHEMBL6585750

SCHEMBL6585750

C=Cc1ccc(OC[C@@H]2CCN2C(=O)OC(C)(C)C)cn1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.41
ALOX5AP P20292 3/20 0.40
FEN1 P39748 1/20 0.40
CHRNA3 P32297 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
SCHEMBL7479360 0.86 CHRNB2 (0.46) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7407720 0.84 CHRNB2 (0.53) GPR119ALOX5APFEN1CHRNA3
SCHEMBL18291358 0.84 ALOX5AP (0.50) GPR119ALOX5APFEN1CHRNA3
SCHEMBL6588716 0.84 CHRNA3 (0.59) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7472930 0.84 CHRNB2 (0.54) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7472876 0.84 CHRNA3 (0.59) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7455050 0.83 GPR119 (0.42) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7408557 0.83 GPR119 (0.48) GPR119ALOX5APFEN1CHRNA3
SCHEMBL7477731 0.82 ALOX5AP (0.42) GPR119ALOX5APFEN1CHRNA3
SCHEMBL6585264 0.82 ALOX5AP (0.42) GPR119ALOX5APFEN1CHRNA3

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
EP-0934308-B1 3-PYRIDYLOXYMETHYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LAB (US) 2004-08-11 EP disclosed
US-6437138-B1 5-BROMO-6-CHLORO-3-(2-(S)-AZETIDINYL OR PYRROLIDINYL-METHOXY) PYRIDINE INTERMEDIATES FOR THE 5-SUBSTITUTED COMPOUNDS WHICH ARE POTENT LIGANDS AT NEURONAL NICOTINIC CHOLINERGIC CHANNEL RECEPTORS, NEUROTRANSMITTER CONTROLLING AGENTS ABBOTT LABORATORIES 2002-08-20 US disclosed
US-6127386-A STIMULANTS, NEUROTRANSMITTERS, CHOLINERGIC AGENTS ABBOTT LABORATORIES (US) 2000-10-03 US disclosed