SCHEMBL7182525

SCHEMBL7182525

CC(C)CCCCCCC(Cl)CC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 2/20 0.43
KDM4A O75164 1/20 0.43
PHF8 Q9UPP1 1/20 0.43
KDM2A Q9Y2K7 1/20 0.43
GPR84 Q9NQS5 4/20 0.42
BLM P54132 1/20 0.39
LMNA P02545 1/20 0.36
CACNA2D1 P54289 2/20 0.35
CACNB3 P54284 1/20 0.35
CACNA1C Q13936 1/20 0.35
PGR P06401 1/20 0.35
ADRA1A P35348 1/20 0.35
HTR2B P41595 1/20 0.35
CACNA2D2 Q9NY47 1/20 0.35
FFAR4 Q5NUL3 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
FFAR1 O14842 1/20 0.33

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
SCHEMBL6460719 1.00 KDM4C (0.43) KDM4CKDM4APHF8KDM2AGPR84
SCHEMBL5741494 1.00 KDM4C (0.43) KDM4CKDM4APHF8KDM2AGPR84
SCHEMBL6462902 1.00 KDM4C (0.43) KDM4CKDM4APHF8KDM2AGPR84
SCHEMBL6465236 0.98 BLM (0.41) KDM4CKDM4APHF8KDM2AGPR84
SCHEMBL6460876 0.94 BLM (0.45) KDM4CKDM4APHF8KDM2AGPR84
SCHEMBL9620654 0.89 GPR84 (0.45) GPR84LMNAFFAR4FFAR1
SCHEMBL6466477 0.85 CACNA2D1 (0.39) BLMCACNA2D1CACNB3CACNA1CPGR
SCHEMBL6466759 0.83 GPR84 (0.62) GPR84FFAR4FFAR1
SCHEMBL28499460 0.83 GPR84 (0.62) GPR84FFAR4FFAR1
SCHEMBL29894891 0.83 GPR84 (0.62) GPR84FFAR4FFAR1

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
EP-1344763-A1 Process for producing optically active 3-halogenocarboxylic acid esters and 3-azide-carboxylic acid esters Takasago International Corporation (JP) 2003-09-17 EP disclosed