SCHEMBL8057709

SCHEMBL8057709

C=C(COCC(=C)C(=O)OC1CCC(C(C)(C)C)CC1)C(=O)OC1CCC(C(C)(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
HTT P42858 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP19A1 P11511 1/20 0.43
MAPT P10636 5/20 0.42
GAA P10253 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
LIPA P38571 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
EPHX1 P07099 1/20 0.33
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSD11B1 P28845 1/20 0.32
CYP2D6 P10635 1/20 0.32
RECQL P46063 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL352105 0.89 APOBEC3A (0.39) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E
SCHEMBL16416230 0.85 APOBEC3A (0.46) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E
SCHEMBL19125861 0.84 APOBEC3A (0.44) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E
SCHEMBL19056002 0.81 APOBEC3A (0.43) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E
SCHEMBL28508307 0.80 MAPT (0.46) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E
SCHEMBL22799034 0.80 MAPT (0.46) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E
SCHEMBL439526 0.80 MAPT (0.46) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E
SCHEMBL25175298 0.78 MAPT (0.45) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E
SCHEMBL1520936 0.78 EPHX1 (0.42) HTTSMN1; SMN2CYP19A1EPHX1L3MBTL1
SCHEMBL13266327 0.75 MAPT (0.43) APOBEC3AAPOBEC3GHTTSMN1; SMN2KDM4E

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
JP-2000239325-A TRANSPARENT RESIN COMPOSITION MITSUBISHI RAYON CO LTD 2000-09-05 JP disclosed