SCHEMBL5604032

SCHEMBL5604032

CC(C)(c1ccc(Oc2ccccc2N)cc1)c1ccc(C(C)(C)c2ccc(Oc3ccccc3N)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.53
RCE1 Q9Y256 1/20 0.53
ALDH1A1 P00352 5/20 0.50
IKBKB O14920 1/20 0.50
BRAF P15056 1/20 0.50
ADRA2B P18089 1/20 0.45
PTGS1 P23219 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
RAB9A P51151 2/20 0.45
LTA4H P09960 1/20 0.44
MAPT P10636 3/20 0.44
MAPK1 P28482 2/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
KDM4E B2RXH2 1/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL144019 1.00 GAA (0.53) GAARCE1ALDH1A1IKBKBBRAF
SCHEMBL30354049 1.00 GAA (0.53) GAARCE1ALDH1A1IKBKBBRAF
SCHEMBL28684533 0.89 GAA (0.53) GAARCE1ALDH1A1IKBKBBRAF
SCHEMBL6832306 0.87 GAA (0.51) GAARCE1ALDH1A1IKBKBBRAF
SCHEMBL8671112 0.86 MAPT (0.42) GAARCE1ALDH1A1IKBKBBRAF
SCHEMBL10392468 0.85 ALDH1A1 (0.52) GAARCE1ALDH1A1IKBKBBRAF
SCHEMBL1851070 0.85 ALDH1A1 (0.58) GAAALDH1A1TDP1L3MBTL1RAB9A
SCHEMBL8179238 0.84 ALDH1A1 (0.42) GAARCE1ALDH1A1IKBKBBRAF
SCHEMBL2285909 0.84 GAA (0.69) GAARCE1ALDH1A1IKBKBBRAF
SCHEMBL6362905 0.83 GAA (0.47) GAARCE1ALDH1A1IKBKBBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160949-B2 Olefin block copolymers, processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-01-09 US disclosed
EP-1275670-B1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF MITSUI CHEMICALS INC (JP) 2005-08-10 EP disclosed
US-20030055179-A1 Olefin block copolymers processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2003-03-20 US disclosed
EP-1275670-A1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2003-01-15 EP disclosed