SCHEMBL20140460

SCHEMBL20140460

CC(=C(C#N)C#N)c1ccc2cc(N(C)C(C)c3cc(C)ccc3S(=O)(=O)O)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.46
MAPT P10636 1/20 0.46
SNCA P37840 1/20 0.46
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP2A6 P11509 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
SCHEMBL20140463 0.78 APP (0.59) APPMAPTSNCA
SCHEMBL19556864 0.78 APP (0.66) APPMAPTSNCA
SCHEMBL15596831 0.71 MAPT (0.54) APPMAPTSNCACYP2A6
SCHEMBL30668499 0.70 MAPT (0.68) APPMAPTSNCAL3MBTL1
SCHEMBL2762740 0.70 MAPT (0.68) APPMAPTSNCAL3MBTL1
SCHEMBL8143544 0.69 LMNA (0.39) MAPTL3MBTL1
SCHEMBL21298993 0.69 APP (0.74) APPMAPTSNCA
SCHEMBL4907472 0.67 APP (0.59) APPMAPTSNCAHTTNPSR1
SCHEMBL531432 0.66 LMNA (0.47) MAPTL3MBTL1
SCHEMBL22769623 0.65 ALDH1A1 (0.33) MAPTL3MBTL1

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
EP-3538161-A1 METHODS FOR MULTI-DOSE SYNTHESIS OF [F-18]FDDNP FOR CLINICAL SETTINGS The Regents of The University of California (US) 2019-09-18 EP disclosed
WO-2018089491-A1 METHODS FOR MULTI-DOSE SYNTHESIS OF [F-18]FDDNP FOR CLINICAL SETTINGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-05-17 WO disclosed