SCHEMBL7204354

SCHEMBL7204354

CCCC(F)CC(=O)OO

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.34
AKR1A1 P14550 1/20 0.34
CHRM3 P20309 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
ADRA1A P35348 1/20 0.34
HRH1 P35367 1/20 0.34
DRD3 P35462 1/20 0.34
SLC6A3 Q01959 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP3A4 P08684 2/20 0.33
TSHR P16473 2/20 0.33
NFKB1 P19838 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
MAPT P10636 1/20 0.32
HDAC7 Q8WUI4 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
SCHEMBL1158791 0.77 TDP1 (0.40) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL2590996 0.76 GPR84 (0.41) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL7498237 0.75
SCHEMBL1706412 0.75
SCHEMBL4267168 0.73
SCHEMBL3844294 0.73
SCHEMBL11507023 0.72
SCHEMBL27813853 0.71 ELANE (0.44) TDP1ALDH1A1MAPT
SCHEMBL7181549 0.71 CA2 (0.46) TDP1CYP3A4TSHRHPGDMAPT
SCHEMBL5196980 0.70 CHRM1 (0.34) CHRM1AKR1A1CHRM3HTR2AHTR2C

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
EP-1342110-A2 OPTICAL WAVEGUIDES AND METHODS FOR MAKING THE SAME Goodrich Corporation (US) 2003-09-10 EP disclosed
WO-2002010810-A2 OPTICAL WAVEGUIDES AND METHODS FOR MAKING THE SAME GOODRICH CORPORATION (US) 2002-02-07 WO disclosed