SCHEMBL9359862

SCHEMBL9359862

CC(CC(C)(C)c1ccc(Oc2cccc(N)c2)cc1)c1ccc(Oc2cccc(N)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.49
MAPT P10636 4/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
POLB P06746 2/20 0.43
CYP2C9 P11712 1/20 0.43
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MITF O75030 1/20 0.42
GAA P10253 1/20 0.42
GFER P55789 1/20 0.42
NLRP1 Q9C000 1/20 0.42
NOD2 Q9HC29 1/20 0.42
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
LTA4H P09960 1/20 0.40
CYP3A4 P08684 2/20 0.40
TP53 P04637 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
SCHEMBL10716629 0.86 MAPT (0.63) MAOBMAPTNPC1RAB9APOLB
SCHEMBL29436304 0.80 MAOB (0.54) MAOBMAPTPOLBALDH1A1SMN1; SMN2
SCHEMBL7865335 0.80 MAOB (0.54) MAOBMAPTPOLBALDH1A1SMN1; SMN2
SCHEMBL21671652 0.79 NPC1 (0.49) MAPTNPC1RAB9APOLBCYP2C9
SCHEMBL9161768 0.79 LTA4H (0.46) MAPTNPC1RAB9APOLBCYP2C9
SCHEMBL309289 0.78 MAOB (0.63) MAOBMAPTNPC1RAB9APOLB
SCHEMBL31563609 0.78 MAOB (0.63) MAOBMAPTNPC1RAB9APOLB
SCHEMBL29363383 0.78 MAOB (0.63) MAOBMAPTNPC1RAB9APOLB
SCHEMBL15474288 0.78 MAOB (0.63) MAOBMAPTNPC1RAB9APOLB
SCHEMBL7858687 0.78 MAOB (0.63) MAOBMAPTNPC1RAB9APOLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0192480-B1 Bis(3-aminophenoxy) aromatics and method of preparing the same MITSUI TOATSU CHEMICALS (JP) 1994-11-23 EP disclosed
US-5077436-A Reacting dihydroxy derivatives with m-dinitrobenzene; reducing MITSUI TOATSU CHEMICALS, INC. (JP) 1991-12-31 US disclosed
EP-0192480-A1 Bis(3-aminophenoxy) aromatics and method of preparing the same MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-08-27 EP disclosed