SCHEMBL6744455

SCHEMBL6744455

CCCCCCCCCCCCCCCC(N)=CCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.48
SPHK1 Q9NYA1 1/20 0.48
FAAH O00519 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
SOAT1 P35610 2/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
KDM4E B2RXH2 2/20 0.41
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41
TSHR P16473 4/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
HSD17B10 Q99714 2/20 0.40
PPARG P37231 4/20 0.39
PPARD Q03181 4/20 0.39
PPARA Q07869 4/20 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
SCHEMBL2361178 1.00 SPHK2 (0.48) SPHK2SPHK1FAAHMEN1KMT2A
SCHEMBL2896153 0.90 FAAH (0.61) FAAHMEN1KMT2ASOAT1TP53
SCHEMBL9246357 0.90 FAAH (0.47) SPHK2SPHK1FAAHMEN1KMT2A
SCHEMBL3506703 0.86 FAAH (0.43) SPHK2SPHK1FAAHMEN1KMT2A
SCHEMBL15265071 0.84 SPHK2 (0.50) SPHK2SPHK1FAAHMEN1KMT2A
SCHEMBL4542242 0.84 SPHK2 (0.50) SPHK2SPHK1FAAHMEN1KMT2A
SCHEMBL13061757 0.84 SPHK2 (0.50) SPHK2SPHK1FAAHMEN1KMT2A
SCHEMBL28004444 0.84 SPHK2 (0.50) SPHK2SPHK1FAAHMEN1KMT2A
SCHEMBL11036898 0.84 SPHK2 (0.50) SPHK2SPHK1FAAHMEN1KMT2A
SCHEMBL15265074 0.84 SPHK2 (0.50) SPHK2SPHK1FAAHMEN1KMT2A

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
JP-2004083779-A YELLOW PIGMENT COMPOSITION AND METHOD FOR PRODUCING THE SAME SANYO SHIKISO KK 2004-03-18 JP disclosed