SCHEMBL6606071

SCHEMBL6606071

O=CCN(Cc1cc(F)cc(F)c1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.39
PKM P14618 1/20 0.35
NR3C1 P04150 5/20 0.34
ERN1 O75460 1/20 0.34
METAP2 P50579 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
AGER Q15109 2/20 0.32
MTNR1A P48039 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 0.32
SNCA P37840 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
SCHEMBL7965956 0.84 SMN1; SMN2 (0.46) TDP1AGERMTNR1ASMN1; SMN2LMNA
SCHEMBL376141 0.78 LMNA (0.52) TDP1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL4667136 0.73 MEN1 (0.45) MEN1KMT2ACES2CES1
SCHEMBL19949104 0.71 KMT2A (0.45) TDP1MEN1KMT2A
SCHEMBL17801922 0.70 TSHR (0.55) TDP1MEN1KMT2ASMN1; SMN2SNCA
SCHEMBL2468579 0.70 LMNA (0.32) LMNA
SCHEMBL30481859 0.69 IDO1 (0.36) TDP1PKMNR3C1METAP2CES2
SCHEMBL6412500 0.69 LMNA (0.49) TDP1MEN1KMT2ALMNA
SCHEMBL3127194 0.69 LOXL2 (0.51) TDP1SMN1; SMN2LMNA
SCHEMBL7609127 0.67 ALDH1A1 (0.50) TDP1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1395251-A2 AMINEDIOLS AS AGENTS FOR THE TREATMENT OF ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-10 EP disclosed
WO-2002100818-A2 AMINEDIOLS AS AGENTS FOR THE TREATMENT OF ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed