SCHEMBL412444

SCHEMBL412444

CCCC(O)CCC(O)CCC(O)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
FDPS P14324 1/20 0.38
TSHR P16473 6/20 0.37
CHRM1 P11229 1/20 0.33
AKR1A1 P14550 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33
HRH1 P35367 1/20 0.33
DRD3 P35462 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
FFAR1 O14842 1/20 0.33
NFKB1 P19838 3/20 0.32
CYP3A4 P08684 2/20 0.32
NPSR1 Q6W5P4 2/20 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
SCHEMBL6286014 1.00 LMNA (0.40) LMNAFDPSTSHRCHRM1AKR1A1
Hexan-3-Ol SCHEMBL1462441 0.94
Hexan-3-Ol SCHEMBL11796163 0.94 LMNA (0.43) LMNAFDPSTSHRCHRM1AKR1A1
Hexan-3-Ol SCHEMBL464395 0.94
Hexan-3-Ol SCHEMBL15033 0.94
Hexan-3-Ol SCHEMBL28179662 0.90
Hexan-3-Ol SCHEMBL20916928 0.90
Hexan-3-Ol SCHEMBL27896438 0.90
Hexan-3-Ol SCHEMBL6014577 0.90
Hexan-3-Ol SCHEMBL27558536 0.90

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
US-20120021350-A1 ELECTROPHOTOGRAPHIC TONER KAO CORPORATION (JP) 2012-01-26 US disclosed