SCHEMBL6583448

SCHEMBL6583448

CN1CCCC1COc1cncc(/C=C/c2ccccc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 11/20 1.00
CHRNB4 P30926 10/20 1.00
CHRNA3 P32297 10/20 1.00
CHRNB1 P11230 9/20 1.00
CHRNB3 Q05901 9/20 1.00
JAK2 O60674 1/20 0.67
CHRNA4 P43681 4/20 0.63
CHRNA1 P02708 1/20 0.61
CHRNA7 P36544 1/20 0.61

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
SCHEMBL6588752 1.00 CHRNB2 (1.00) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
SCHEMBL6583713 1.00 CHRNB2 (1.00) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
Hydrochloric Acid SCHEMBL6584652 0.99 CHRNB2 (0.98) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
SCHEMBL6583361 0.91 CHRNB2 (1.00) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
SCHEMBL6583359 0.91 CHRNB2 (1.00) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
Hydrochloric Acid SCHEMBL6585317 0.90 CHRNB2 (0.98) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
Hydrochloric Acid SCHEMBL6585314 0.90 CHRNB2 (0.98) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
SCHEMBL6583520 0.84 CHRNB2 (0.87) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
SCHEMBL6585953 0.83 CHRNB2 (0.71) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3
Hydrochloric Acid SCHEMBL7674161 0.83 CHRNB2 (0.85) CHRNB2CHRNB4CHRNA3CHRNB1CHRNB3

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
EP-0934308-B1 3-PYRIDYLOXYMETHYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LAB (US) 2004-08-11 EP disclosed