SCHEMBL9184233

SCHEMBL9184233

Fc1ccc(C2CCC(C3CC[CH]CC3)CC2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
USP5 P45974 2/20 0.36
HDAC6 Q9UBN7 1/20 0.36
KDM1A O60341 2/20 0.35
MAOB P27338 1/20 0.35
USP30 Q70CQ3 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
GRIA4 P48058 1/20 0.32
HCRTR2 O43614 2/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
SCD5 Q86SK9 1/20 0.31
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL9184228 1.00 HTR2A (0.37) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL9185425 0.89 HTR2A (0.41) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL8767567 0.85 HTR2A (0.39) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL9185400 0.85 KDM1A (0.46) KDM1A
SCHEMBL9185405 0.85 KDM1A (0.46) KDM1A
SCHEMBL9178922 0.85 SLC6A2 (0.35) USP5HDAC6SLC6A2SLC6A4SLC6A3
SCHEMBL9178918 0.85 SLC6A2 (0.35) USP5HDAC6SLC6A2SLC6A4SLC6A3
SCHEMBL29389392 0.84 HTR2A (0.46) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL808710 0.84 HTR2A (0.46) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL23366152 0.84 HTR2A (0.38) HTR2AHTR2CHTR2BUSP5HDAC6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6199737-A None JP disclosed
US-5380462-A Cyclohexyl alkenoate compounds HOFFMANN-LA ROCHE INC. (US) 1995-01-10 US disclosed
JP-H06199737-A CYCLOHEXYL ALKENOATES F HOFFMANN LA ROCHE AG 1994-07-19 JP disclosed