SCHEMBL28524527

SCHEMBL28524527

CCC(=O)NCC(=O)OC1CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
EPHX1 P07099 1/20 0.42
NAAA Q02083 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RECQL P46063 1/20 0.38
MAPT P10636 1/20 0.38
APOBEC3A P31941 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
CYP19A1 P11511 3/20 0.36
EPHX2 P34913 2/20 0.36
HTT P42858 2/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PRSS1 P07477 1/20 0.35
TPSAB1 Q15661 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TSHR P16473 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
SCHEMBL27890002 0.78 EPHX1 (0.43) GAAEPHX1NAAAMEN1KMT2A
SCHEMBL2253713 0.77
SCHEMBL21765657 0.77 NAAA (0.48) GAAEPHX1NAAAAPOBEC3AAPOBEC3G
SCHEMBL7174165 0.76 EPHX1 (0.37) GAAEPHX1NAAAMAPTAPOBEC3A
SCHEMBL28574621 0.75
SCHEMBL5184954 0.75 GAA (0.68) GAAMEN1KMT2ARECQLMAPT
Hydrochloric Acid SCHEMBL22466294 0.74
SCHEMBL9853078 0.74 RECQL (0.64) GAAMEN1KMT2ARECQLEPHX2
SCHEMBL28037534 0.74
SCHEMBL11186733 0.74 NAAA (0.38) GAAEPHX1NAAAMAPTAPOBEC3A

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-112423774-A Therapeutic compositions and methods of use for treating mild cognitive impairment, depression and psychological disorders L·H·L·特兰 2021-02-26 CN disclosed