SCHEMBL8259987

SCHEMBL8259987

FC(F)(F)c1cc(Cl)c(-c2cccc3c2OCCC3)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.35
HTR7 P34969 2/20 0.35
TRPM8 Q7Z2W7 3/20 0.34
FABP3 P05413 1/20 0.33
FABP4 P15090 1/20 0.33
THRB P10828 1/20 0.33
DRD2 P14416 1/20 0.33
CDK2 P24941 1/20 0.32
CDK9 P50750 1/20 0.32
P2RX1 P51575 1/20 0.32
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL8256849 0.86 PARP1 (0.34) HTR1AHTR7CDK2CDK9MAPT
SCHEMBL8257859 0.86 SCN9A (0.40) HTR1AHTR7TRPM8THRBDRD2
SCHEMBL8258997 0.85 HTR1A (0.38) HTR1AHTR7CDK2CDK9
SCHEMBL8258142 0.79 XDH (0.35) TRPM8CDK2CDK9
SCHEMBL8259066 0.79 ALDH1A1 (0.36) HTR7DRD2MAPT
SCHEMBL8248843 0.77 LMNA (0.36) HTR1ACDK2CDK9MAPT
SCHEMBL8254298 0.76 DRD2 (0.35) HTR1AHTR7DRD2CDK2CDK9
SCHEMBL8258120 0.75 CNR2 (0.36) FABP3FABP4CDK2CDK9SCN9A
SCHEMBL8211899 0.73 NFKB1 (0.41) HTR1AHTR7TRPM8THRBDRD2
SCHEMBL8248817 0.72 AQP1 (0.38) HTR1AHTR7TRPM8MAPTNPSR1

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-2006116165-A1 CHROMANE AND CHROMENE DERIVATIVES AND USES THEREOF WYETH (US) 2006-11-02 WO disclosed