SCHEMBL2791982

SCHEMBL2791982

CCOC(=O)c1c(OCc2ccccc2)c(=O)n(C)n1CCOCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 2/20 0.39
PPARG P37231 1/20 0.39
MAOB P27338 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 2/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
RECQL P46063 1/20 0.38
MAPK10 P53779 1/20 0.38
HSP90AA1 P07900 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL754152 0.90 LMNA (0.41) LMNAHPGDMAPTALDH1A1GAA
SCHEMBL19646278 0.77 ALDH1A1 (0.43) LMNAHPGDMAPTALDH1A1GAA
SCHEMBL752484 0.76 SRD5A2 (0.40) LMNAHPGDALDH1A1GAASMN1; SMN2
SCHEMBL9199566 0.72 SMN1; SMN2 (0.47) LMNAHPGDMAPTALDH1A1GAA
SCHEMBL21248208 0.71 SMN1; SMN2 (0.42) LMNAHPGDMAPTALDH1A1GAA
SCHEMBL756756 0.71 RAB9A (0.48) LMNAHPGDMAPTALDH1A1GAA
SCHEMBL17848969 0.71 KDM4E (0.47) HPGDMAPTALDH1A1GAASMN1; SMN2
SCHEMBL16640636 0.70 TSHR (0.43) LMNAHPGDMAPTALDH1A1GAA
SCHEMBL753172 0.70 APP (0.38) LMNAHPGDALDH1A1GAAMAOB
SCHEMBL20101954 0.70 SMN1; SMN2 (0.50) LMNAHPGDMAPTALDH1A1GAA

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-2181985-A1 Antiviral Agent SHIONOGI & CO., LTD. (JP) 2010-05-05 EP disclosed