SCHEMBL3368133

SCHEMBL3368133

CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2c1ccc1ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.39
GAA P10253 5/20 0.37
KDM4E B2RXH2 4/20 0.37
NPC1 O15118 4/20 0.37
ALDH1A1 P00352 4/20 0.37
HTT P42858 4/20 0.37
RAB9A P51151 4/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPK1 P28482 1/20 0.37
RAD52 P43351 1/20 0.37
MMP2 P08253 2/20 0.36
MMP9 P14780 2/20 0.36

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
SCHEMBL10019102 0.92 CNR1 (0.34) CNR1GAAKDM4ENPC1ALDH1A1
SCHEMBL10019101 0.90 TDP1 (0.36) CNR1GAANPSR1CYP2C19TDP1
SCHEMBL10019096 0.85 SLC6A4 (0.33) CNR1CYP2D6PDK2
SCHEMBL15870953 0.85 CNR1 (0.37) CNR1GAAKDM4ENPC1ALDH1A1
SCHEMBL20407353 0.82 CNR1 (0.34) CNR1GAAKDM4ENPC1ALDH1A1
SCHEMBL14736023 0.80 APEX1 (0.47) GAAMEN1KMT2ANPSR1CYP2C19
SCHEMBL6060635 0.80 APEX1 (0.47) GAAMEN1KMT2ANPSR1CYP2C19
SCHEMBL6060689 0.80 APEX1 (0.47) GAAMEN1KMT2ANPSR1CYP2C19
SCHEMBL1395156 0.80 APEX1 (0.47) GAAMEN1KMT2ANPSR1CYP2C19
SCHEMBL17034549 0.80 APEX1 (0.47) GAAMEN1KMT2ANPSR1CYP2C19

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
US-8349997-B2 Method for production of block copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-01-08 US disclosed
US-20100099823-A1 METHOD FOR PRODUCTION OF BLOCK COPOLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-22 US disclosed
EP-2112186-A1 METHOD FOR PRODUCTION OF BLOCK COPOLYMER Sumitomo Chemical Company, Limited (JP) 2009-10-28 EP disclosed