SCHEMBL28398577

SCHEMBL28398577

CCCCCCCCCCCCC(C#N)C(O)CCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.44
SPHK1 Q9NYA1 2/20 0.44
FFAR1 O14842 2/20 0.44
CYP2D6 P10635 2/20 0.41
LMNA P02545 2/20 0.41
GMNN O75496 1/20 0.41
POLB P06746 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
BLM P54132 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CETP P11597 1/20 0.41
HTT P42858 1/20 0.41
UBE2N P61088 1/20 0.41
FFAR4 Q5NUL3 1/20 0.36
FDPS P14324 1/20 0.35

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
SCHEMBL28395145 1.00 GPR84 (0.44) GPR84SPHK1FFAR1CYP2D6LMNA
SCHEMBL4920628 0.92 SPHK1 (0.48) GPR84SPHK1FFAR1CYP2D6LMNA
SCHEMBL28880908 0.89 SPHK1 (0.37) GPR84SPHK1FFAR1CYP2D6LMNA
SCHEMBL11028135 0.83 GPR84 (0.42) GPR84SPHK1FFAR1CYP2D6LMNA
SCHEMBL27641944 0.82 SPHK1 (0.45) GPR84SPHK1FFAR1CYP2D6LMNA
SCHEMBL29000834 0.82 SPHK1 (0.45) GPR84SPHK1FFAR1CYP2D6LMNA
SCHEMBL3965971 0.81 TSHR (0.50) GPR84SPHK1FFAR1CYP2D6LMNA
SCHEMBL10987090 0.80 TSHR (0.46) GPR84SPHK1FFAR1LMNAFDPS
SCHEMBL14403190 0.78 TSHR (0.36) GPR84SPHK1FFAR1LMNAFDPS
SCHEMBL28880011 0.76 SPHK1 (0.39) GPR84SPHK1FFAR1CYP2D6LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111039977-B Phosphorylylation reagent and application thereof in oligonucleotide synthesis 广州同隽医药科技有限公司 2022-11-08 CN disclosed
CN-111039977-A Phosphorylylation reagent and application thereof in oligonucleotide synthesis 广州同隽医药科技有限公司 2020-04-21 CN disclosed