SCHEMBL9766360

SCHEMBL9766360

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

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.41
SPHK1 Q9NYA1 1/20 0.41
FFAR1 O14842 1/20 0.41
PTPN1 P18031 1/20 0.41
MAPT P10636 1/20 0.40
FAAH O00519 1/20 0.39
SMPD1 P17405 3/20 0.38
FFAR4 Q5NUL3 1/20 0.38
ACE2 Q9BYF1 1/20 0.38

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
SCHEMBL9766333 1.00 GPR84 (0.41) GPR84SPHK1FFAR1PTPN1MAPT
SCHEMBL8534554 0.85 SMPD1 (0.40) GPR84SPHK1FFAR1PTPN1MAPT
SCHEMBL7611323 0.83 SMPD1 (0.39) GPR84SPHK1FFAR1PTPN1MAPT
SCHEMBL3024803 0.82 OPRM1 (0.38) GPR84PTPN1MAPTSMPD1ACE2
SCHEMBL8975852 0.81 SMPD1 (0.38) GPR84PTPN1MAPTSMPD1ACE2
SCHEMBL7543272 0.79 GPR84 (0.45) GPR84SPHK1FFAR1MAPTSMPD1
SCHEMBL305164 0.79 GPR84 (0.45) GPR84SPHK1FFAR1MAPTSMPD1
SCHEMBL303992 0.79 GPR84 (0.45) GPR84SPHK1FFAR1MAPTSMPD1
SCHEMBL303234 0.79 GPR84 (0.45) GPR84SPHK1FFAR1MAPTSMPD1
SCHEMBL304347 0.79 GPR84 (0.45) GPR84SPHK1FFAR1MAPTSMPD1

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