SCHEMBL28239249

SCHEMBL28239249

Fc1[c]ccc(OCc2ccccc2)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HTR1A P08908 3/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
KDM1A O60341 5/20 0.42
DRD2 P14416 1/20 0.42
LIPE Q05469 1/20 0.41
NPC1 O15118 1/20 0.40
LTA4H P09960 1/20 0.40
MAPK14 Q16539 1/20 0.40
GAA P10253 1/20 0.40
ALPG P10696 1/20 0.39
PTK2B Q14289 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL27617230 0.83 MAPT (0.42) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL7911621 0.83 LMNA (0.43) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL3211927 0.81 MAPT (0.50) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL27617206 0.76 MAPT (0.36) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL29145843 0.76 SLC6A2 (0.47) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL8079401 0.76 PTGER1 (0.49) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL1003999 0.74 L3MBTL1 (0.38) MAPTMAPK1TDP1L3MBTL1KDM1A
SCHEMBL10517942 0.73 KDM1A (0.49) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL15129422 0.73 KDM1A (0.60) MAPTMAPK1TDP1L3MBTL1HTR1A
SCHEMBL30080427 0.73 MAPT (0.58) MAPTMAPK1TDP1L3MBTL1HTR1A

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
CN-104936955-B Thiadiazoles analog and treatment lack the method for relevant illness with SMN 诺华股份有限公司 2018-08-28 CN disclosed