SCHEMBL28032351

SCHEMBL28032351

CCCCCCCCCCCCCCCCCCC[C@@H](O)[C@H](N)C(=O)O.[NaH]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.57
SPHK1 Q9NYA1 2/20 0.57
FFAR1 O14842 1/20 0.57
CYP2D6 P10635 2/20 0.53
MAPT P10636 2/20 0.53
GMNN O75496 1/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 1/20 0.53
THPO P40225 1/20 0.53
MTOR P42345 1/20 0.53
BLM P54132 1/20 0.53
KDM4E B2RXH2 1/20 0.53
TP53 P04637 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CETP P11597 1/20 0.53
HTT P42858 1/20 0.53
UBE2N P61088 1/20 0.53
GRIK1 P39086 2/20 0.51
GRIK2 Q13002 2/20 0.51

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
SCHEMBL28032356 1.00 GPR84 (0.57) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL28433674 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL11115743 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL28433675 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL25266087 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL25193896 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL11121661 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL19132466 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL21853754 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT
SCHEMBL497548 0.98 GPR84 (0.59) GPR84SPHK1FFAR1CYP2D6MAPT

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
CN-104955472-A Fatty acid acylated amino acids for growth hormone delivery NOVO NORDISK HEALTHCARE AG 2015-09-30 CN disclosed