SCHEMBL20201608

SCHEMBL20201608

C[C@@H]1CCCc2c1ccc(F)c2OCCC1CC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.34
NFE2L2 Q16236 1/20 0.32
HPGD P15428 2/20 0.31
SCN9A Q15858 1/20 0.31
OPRL1 P41146 4/20 0.30
MCHR1 Q99705 1/20 0.30

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
SCHEMBL20376466 0.86 FEN1 (0.36)
SCHEMBL20206761 0.86 FEN1 (0.36)
SCHEMBL20204881 0.78 ALOX5AP (0.35)
SCHEMBL20206763 0.77 ADRA1A (0.32) OPRL1
SCHEMBL20204879 0.77 ADRA1A (0.32) OPRL1
SCHEMBL21325048 0.73 ALOX5AP (0.34)
SCHEMBL21325344 0.73 ALOX5AP (0.34)
SCHEMBL20201600 0.70 FABP4 (0.36)
SCHEMBL21533978 0.70 FEN1 (0.37)
SCHEMBL21325054 0.69 ALOX5AP (0.34)

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