SCHEMBL20201668

SCHEMBL20201668

Cc1ccc(F)c(OC[C@H]2CCCN2)c1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 2/20 0.56
▸ CHRNA4 P43681 1/20 0.56
▸ CHRNB4 P30926 5/20 0.55
▸ CHRNA3 P32297 5/20 0.55
▸ SLC6A2 P23975 1/20 0.48
▸ CHRNA5 P30532 1/20 0.48
▸ LTA4H P09960 1/20 0.47

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
SCHEMBL20201654 1.00 CHRNB2 (0.56) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL13419311 0.89 CHRNB2 (0.56) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL21324932 0.83 CHRNB4 (0.51) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL21324922 0.83 CHRNB4 (0.51) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL20208311 0.83 CHRNB4 (0.51) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL20376493 0.83 CHRNB4 (0.51) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL12122986 0.81 CHRNB2 (0.50) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA5
SCHEMBL2202872 0.80 CHRNB4 (0.68) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL2202866 0.80 CHRNB4 (0.68) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL24153920 0.78 SCN9A (0.43) SLC6A2

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
WO-2018098206-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 — — WO disclosed
WO-2018098207-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 — — WO disclosed
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