SCHEMBL20201618

SCHEMBL20201618

CC(C)[C@H]1CCc2c1ccc(F)c2OCC1CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 4/20 0.36
FEN1 P39748 4/20 0.36
ACACB O00763 1/20 0.33
FFAR1 O14842 2/20 0.32
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
HTR2C P28335 1/20 0.32
HTR7 P34969 1/20 0.32
HTR2B P41595 1/20 0.32
HTR3A P46098 1/20 0.32
HTR4 Q13639 1/20 0.32

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
SCHEMBL21533978 0.92 FEN1 (0.37) ALOX5APFEN1ACACBFFAR1
SCHEMBL20206774 0.84 ADRA1A (0.38) ALOX5APFEN1ACACBHTR2CHTR7
SCHEMBL20204881 0.82 ALOX5AP (0.35) ALOX5APFEN1ACACBFFAR1HTR2C
SCHEMBL20190174 0.82 S1PR1 (0.39) ALOX5APFEN1DRD2DRD3HTR2C
SCHEMBL21325347 0.78 RIPK1 (0.34) ALOX5APFEN1FFAR1HTR2CHTR2B
SCHEMBL21325053 0.78 RIPK1 (0.34) ALOX5APFEN1FFAR1HTR2CHTR2B
SCHEMBL20206761 0.77 FEN1 (0.36) ALOX5APFEN1FFAR1HTR2CHTR2B
SCHEMBL20376466 0.77 FEN1 (0.36) ALOX5APFEN1FFAR1HTR2CHTR2B
SCHEMBL21324930 0.76 FABP4 (0.35) ALOX5APFEN1ACACB
SCHEMBL21325344 0.74 ALOX5AP (0.34) ALOX5APFEN1FFAR1HTR2CHTR2B

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