SCHEMBL6290876

SCHEMBL6290876

Nc1ccccc1Nc1ccc(Oc2ccc(C(c3ccc(Oc4ccc(Nc5ccccc5N)cc4)cc3)(C(F)(F)F)C(F)(F)F)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.54
GAA P10253 5/20 0.54
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
RAB9A P51151 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
THRB P10828 1/20 0.54
HTT P42858 1/20 0.54
RECQL P46063 1/20 0.54
MMP14 P50281 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.50
TP53 P04637 1/20 0.50
APP P05067 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
SNCA P37840 1/20 0.50
BLM P54132 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL6290887 0.91 MAPT (0.59) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL9575352 0.85 GAA (0.59) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL3977426 0.81 MAPT (0.68) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL3980084 0.80 MAPT (0.61) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL18872955 0.78 MAPT (0.44) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL15875869 0.78 MAPT (0.68) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL29824523 0.78 MAPT (0.68) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL4606261 0.78 MAPK1 (0.55) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL3981866 0.77 MAPT (0.61) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL3977454 0.77 MAPT (0.61) MAPTGAAKDM4EALDH1A1MEN1

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
US-6855774-B2 Crosslinkable elastomer composition DAIKIN INDUSTRIES, LTD. (JP) 2005-02-15 US disclosed
US-20030191247-A1 Crosslinkable elastomer composition DAIKIN INDUSTRIES, LTD. (JP) 2003-10-09 US disclosed