SCHEMBL16077906

SCHEMBL16077906

CC(C)(C)c1ccccc1/N=C/c1cccc(/C=N/c2ccccc2C(C)(C)C)n1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.70
MAPT P10636 4/20 0.70
PLA2G1B P04054 1/20 0.70
ATG4B Q9Y4P1 1/20 0.70
ALOX12 P18054 1/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
CA2 P00918 2/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
TSHR P16473 2/20 0.34
CHAT P28329 1/20 0.33

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
SCHEMBL27993939 0.83 ALDH1A1 (0.58) ALDH1A1MAPTPLA2G1BATG4BKDM4E
SCHEMBL14280786 0.82 ALDH1A1 (0.49) ALDH1A1MAPTPLA2G1BATG4BALOX12
SCHEMBL12725749 0.80 MAPT (0.66) ALDH1A1MAPTPLA2G1BATG4BKDM4E
SCHEMBL1634970 0.80 MAPT (0.66) ALDH1A1MAPTPLA2G1BATG4BKDM4E
SCHEMBL5589183 0.77 ALDH1A1 (0.51) ALDH1A1MAPTPLA2G1BATG4BKDM4E
SCHEMBL5589179 0.77 ALDH1A1 (0.51) ALDH1A1MAPTPLA2G1BATG4BKDM4E
SCHEMBL22243289 0.76 ALDH1A1 (0.54) ALDH1A1MAPTPLA2G1BATG4BGRIN2D
SCHEMBL14816945 0.75 ALDH1A1 (0.51) ALDH1A1MAPTPLA2G1BATG4BALOX12
SCHEMBL5590195 0.75 ALDH1A1 (0.50) ALDH1A1MAPTPLA2G1BATG4BKDM4E
SCHEMBL13259134 0.74 ALDH1A1 (0.41) ALDH1A1MAPTPLA2G1BATG4BGRIN2D

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-9695260-B2 Method for producing olefin block polymer using plurality of types of transition metal catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-04 US disclosed
US-20140275429-A1 METHOD FOR PRODUCING OLEFIN BLOCK POLYMER USING PLURALITY OF TYPES OF TRANSITION METAL CATALYSTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-18 US disclosed