SCHEMBL10476052

SCHEMBL10476052

CC(c1ccc(Oc2cccc(N)c2)cc1)c1ccc(Oc2cccc(N)c2)cc1.Nc1cccc(Oc2ccc(Cc3ccc(Oc4cccc(N)c4)cc3)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.53
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MITF O75030 1/20 0.46
GAA P10253 1/20 0.46
GFER P55789 1/20 0.46
NLRP1 Q9C000 1/20 0.46
NOD2 Q9HC29 1/20 0.46
LTA4H P09960 1/20 0.43
CYP3A4 P08684 2/20 0.42
TP53 P04637 1/20 0.42
ATM Q13315 1/20 0.41
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.41
GRIN1 Q05586 1/20 0.40
GRIN2B Q13224 1/20 0.40
ACACB O00763 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
SCHEMBL16678937 0.91 MAOB (0.53) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL29363383 0.91 MAOB (0.63) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL309289 0.91 MAOB (0.63) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL9248858 0.87 MAOB (0.68) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL307492 0.87 MAOB (0.68) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL29364255 0.87 MAOB (0.68) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL30148468 0.86 MAOB (0.66) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL14302875 0.84 ALDH1A1 (0.50) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL23322163 0.84 ALDH1A1 (0.66) MAOBALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL7865335 0.84 MAOB (0.54) MAOBALDH1A1SMN1; SMN2MAPTMEN1

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-2479320-B1 FIBER AND FIBER STRUCTURE TEIJIN LTD (JP) 2015-02-25 EP disclosed
EP-2479320-A1 FIBER AND FIBER STRUCTURE Teijin Limited (JP) 2012-07-25 EP disclosed