SCHEMBL28709673

SCHEMBL28709673

NC(=O)OC1CCN(C(=O)c2cccc(-c3cn4ccccc4n3)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.51
ALDH1A1 P00352 10/20 0.51
SMN1; SMN2 Q16637 5/20 0.51
HPGD P15428 4/20 0.51
RAB9A P51151 5/20 0.50
POLB P06746 3/20 0.50
LMNA P02545 2/20 0.50
GFER P55789 2/20 0.50
CLK1 P49759 1/20 0.47
DYRK1A Q13627 1/20 0.47
KMT2A Q03164 3/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TSHR P16473 2/20 0.46
USP2 O75604 1/20 0.46
HTT P42858 1/20 0.46
GAA P10253 2/20 0.45
NPC1 O15118 2/20 0.45
TP53 P04637 2/20 0.45

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
SCHEMBL25311112 0.87 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL25311377 0.85 KDM4E (0.62) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL19322175 0.83 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL25878977 0.82 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL29484624 0.81 RAB9A (0.56) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL25311588 0.81 RAB9A (0.56) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL25311960 0.81 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL25312109 0.80 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL30471101 0.80 KDM4E (0.54) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL25310936 0.80 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A

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-114195780-A Carbonyl heterocyclic compound and application thereof 上海医药集团股份有限公司 2022-03-18 CN disclosed
CN-114195806-A Carbonyl heterocyclic compound and application thereof 上海医药集团股份有限公司 2022-03-18 CN disclosed