SCHEMBL3984150

SCHEMBL3984150

CC(C)(C)C1CCC2C(C1)C2OC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
EPHX1 P07099 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
CYP19A1 P11511 1/20 0.31
LIPA P38571 1/20 0.30

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
SCHEMBL3984069 0.76 EPHX1 (0.31) EPHX1CYP19A1
SCHEMBL3984148 0.72 EPHX1 (0.34) EPHX1KDM4EHTTGLALIPA
SCHEMBL28199763 0.71 MAPT (0.51) MAPTAPOBEC3AAPOBEC3GEPHX1KDM4E
SCHEMBL27052182 0.70 MAPT (0.45) MAPTAPOBEC3AAPOBEC3GGLAGAA
SCHEMBL3979936 0.69 POLB (0.32) EPHX1KDM4E
SCHEMBL3983190 0.69 MEN1 (0.33)
SCHEMBL3983989 0.68 CES2 (0.36) MAPTEPHX1KDM4ESMN1; SMN2
SCHEMBL3981105 0.67 EPHX1 (0.33) MAPTEPHX1LIPA
SCHEMBL3984368 0.66 LMNA (0.33) SMN1; SMN2
SCHEMBL4975666 0.65 LMNA (0.35) SMN1; SMN2

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
EP-1562575-B1 FUSED CYCLOALKYL AMIDES AND ACIDS AND THEIR THERAPEUTIC APPLICATIONS FOR THE TREATMENT OF I.A. EPILEPSY ABBOTT LAB (US) 2009-05-20 EP claimed