SCHEMBL28566122

SCHEMBL28566122

O=C1CN(c2ccc(OC3CCCCC3)cn2)CC(=O)O1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 5/20 0.45
▸ GRM2 Q14416 1/20 0.39
▸ GPR119 Q8TDV5 2/20 0.39
▸ PDGFRB P09619 1/20 0.38
▸ PDGFRA P16234 1/20 0.38
▸ ABL1 P00519 1/20 0.36
▸ CHRM4 P08173 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NPY5R Q15761 1/20 0.35
▸ MAOB P27338 1/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.34
▸ GABRA1 P14867 1/20 0.34
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA3 P34903 1/20 0.34

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
SCHEMBL20000617 0.74 ACACB (0.48) ACACBGPR119HRH3
SCHEMBL30932113 0.74 ACACB (0.48) ACACBGPR119CHRM4HRH3
SCHEMBL23057533 0.69 ACACB (0.49) ACACBGPR119
SCHEMBL19041966 0.69 CLK2 (0.46) ACACBGPR119HRH3
SCHEMBL12949399 0.67 CHRM4 (0.49) PDGFRBPDGFRAABL1CHRM4
SCHEMBL4021756 0.67 MCHR1 (0.45) ACACBPDGFRBPDGFRAABL1HPGD
SCHEMBL2581459 0.67 CHRNA3 (0.48) PDGFRBPDGFRAABL1CHRM4
SCHEMBL16691251 0.67 CHRNB2 (0.46) ACACBPDGFRBPDGFRAABL1HPGD
SCHEMBL2580914 0.67 CHRNA3 (0.48) PDGFRBPDGFRAABL1CHRM4
SCHEMBL2586308 0.67 LOX (0.47) ACACBGRM2PDGFRBPDGFRAABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112679487-A 4- (5- (cyclohexyloxy) pyridine-2-yl) morpholine-2, 6-dione and preparation method and application thereof 张淑华 2021-04-20 — — CN claimed
CN-112679487-A 4- (5- (cyclohexyloxy) pyridine-2-yl) morpholine-2, 6-dione and preparation method and application thereof 张淑华 2021-04-20 — — CN disclosed
CN-112679487-A 4- (5- (cyclohexyloxy) pyridine-2-yl) morpholine-2, 6-dione and preparation method and application thereof 张淑华 2021-04-20 — — CN disclosed
CN-112679487-A 4- (5- (cyclohexyloxy) pyridine-2-yl) morpholine-2, 6-dione and preparation method and application thereof 张淑华 2021-04-20 — — CN disclosed
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