SCHEMBL9766339

SCHEMBL9766339

CCCCCCCCCCCCCCCC(N[C]=O)C(C)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GPR84 Q9NQS5 7/20 0.41
SPHK1 Q9NYA1 2/20 0.41
FFAR1 O14842 1/20 0.41
LMNA P02545 2/20 0.41
ASAH1 Q13510 1/20 0.41
MAPT P10636 2/20 0.40
CYP2D6 P10635 2/20 0.39
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 0.39
GMNN O75496 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL9718526 0.78 SPHK1 (0.48) MEN1KMT2AGPR84SPHK1FFAR1
SCHEMBL11216600 0.78 SPHK1 (0.48) MEN1KMT2AGPR84SPHK1FFAR1
SCHEMBL5493159 0.76 ADH1B (0.53) GPR84SPHK1FFAR1LMNAMAPT
SCHEMBL277122 0.76 ADH1B (0.53) GPR84SPHK1FFAR1LMNAMAPT
SCHEMBL9797214 0.76 ADH1B (0.53) GPR84SPHK1FFAR1LMNAMAPT
SCHEMBL11365045 0.76 ADH1B (0.53) GPR84SPHK1FFAR1LMNAMAPT
SCHEMBL2112384 0.76 ADH1B (0.53) GPR84SPHK1FFAR1LMNAMAPT
SCHEMBL8518528 0.76 ADH1B (0.53) GPR84SPHK1FFAR1LMNAMAPT
SCHEMBL277516 0.76 ADH1B (0.53) GPR84SPHK1FFAR1LMNAMAPT
SCHEMBL18620875 0.76 SPHK1 (0.47) MEN1KMT2AGPR84SPHK1FFAR1

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-5062922-A Storage stability, all ph's ARAKAWA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-11-05 US disclosed