SCHEMBL20206761

SCHEMBL20206761

C[C@@H]1CCCc2c1ccc(F)c2OCC1CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 5/20 0.36
ALOX5AP P20292 3/20 0.36
FFAR1 O14842 1/20 0.33
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
PARP15 Q460N3 1/20 0.31
PARP10 Q53GL7 1/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
HRH2 P25021 1/20 0.30
HRH3 Q9Y5N1 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 1.00 FEN1 (0.36) FEN1ALOX5APFFAR1HCRTR1HCRTR2
SCHEMBL20204881 0.92 ALOX5AP (0.35) FEN1ALOX5APFFAR1HTR2AHTR2C
SCHEMBL20201608 0.86 CXCR2 (0.34)
SCHEMBL20201600 0.83 FABP4 (0.36) FEN1ALOX5APHCRTR1HCRTR2HTR2C
SCHEMBL21533978 0.83 FEN1 (0.37) FEN1ALOX5APFFAR1
SCHEMBL21325048 0.83 ALOX5AP (0.34) FEN1ALOX5APFFAR1HCRTR1HCRTR2
SCHEMBL21325344 0.83 ALOX5AP (0.34) FEN1ALOX5APFFAR1HCRTR1HCRTR2
SCHEMBL21325054 0.79 ALOX5AP (0.34) FEN1ALOX5APFFAR1PARP10HTR2A
SCHEMBL20190174 0.77 S1PR1 (0.39) FEN1ALOX5APHTR2AHTR2CHTR2B
SCHEMBL20201618 0.77 ALOX5AP (0.36) FEN1ALOX5APFFAR1HTR2CHTR2B

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-2018098207-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed
WO-2018098204-A1 6-MEMBERED URACIL ISOSTERES CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed