SCHEMBL20204829

SCHEMBL20204829

Cc1ccc(F)cc1CCCC1CC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 15/20 0.49
SLC6A4 P31645 15/20 0.49
SLC6A3 Q01959 15/20 0.49
OPRL1 P41146 4/20 0.41
CHRM3 P20309 1/20 0.38

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
SCHEMBL18255051 0.82 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3
SCHEMBL20207515 0.81 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3OPRL1
SCHEMBL19658854 0.77 TYR (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL17188320 0.75 ALDH1A1 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL11942564 0.75 ALOX5 (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL14386019 0.74 SLC6A4 (0.41) SLC6A2SLC6A4SLC6A3CHRM3
SCHEMBL13850100 0.74 ALOX5 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL13763 0.74 MPO (0.51) SLC6A2SLC6A4SLC6A3
SCHEMBL20201906 0.73 TAAR1 (0.37) SLC6A2SLC6A4SLC6A3
SCHEMBL12706482 0.73 CEL (0.35) SLC6A2SLC6A4SLC6A3

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
WO-2018098209-A1 AMINO SULFONYL COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed