SCHEMBL5807443

SCHEMBL5807443

NN=Cc1ccccc1OC(F)F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
MAPT P10636 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
GAA P10253 1/20 0.51
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
HPGD P15428 4/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
PTGES2 Q9H7Z7 1/20 0.45
HTT P42858 1/20 0.44
POLB P06746 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
ALDH1A1 P00352 2/20 0.41
DRD1 P21728 1/20 0.40

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
SCHEMBL5807441 1.00 L3MBTL1 (0.56) L3MBTL1MAPTSMN1; SMN2GAANPC1
SCHEMBL5806577 0.83 L3MBTL1 (0.51) L3MBTL1MAPTSMN1; SMN2GAANPC1
SCHEMBL2313267 0.83 ALDH1A1 (0.50) L3MBTL1MAPTSMN1; SMN2GAANPC1
SCHEMBL5806575 0.83 L3MBTL1 (0.51) L3MBTL1MAPTSMN1; SMN2GAANPC1
SCHEMBL28241514 0.83 HPGD (0.56) L3MBTL1MAPTSMN1; SMN2GAANPC1
SCHEMBL1665548 0.76 GRIN2D (0.61) MAPTSMN1; SMN2GAANPC1RAB9A
SCHEMBL29538287 0.76 ALDH1A1 (0.55) L3MBTL1MAPTSMN1; SMN2GAAHPGD
SCHEMBL31182413 0.76 GRIN2D (0.61) MAPTSMN1; SMN2GAANPC1RAB9A
SCHEMBL15678969 0.76 POLB (0.45) L3MBTL1MAPTSMN1; SMN2GAANPC1
SCHEMBL908602 0.76 ALDH1A1 (0.55) L3MBTL1MAPTSMN1; SMN2GAAHPGD

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
WO-2006093518-A2 THIENYL COMPOUNDS FOR TREATING VIRUS-RELATED CONDITIONS APATH, LLC (US) 2006-09-08 WO disclosed