SCHEMBL2763049

SCHEMBL2763049

CC12CC3(C)CC(c4cccc(C56CC7(C)CC(C)(C5)CC(c5cc(C#Cc8ccccc8)c(C#Cc8ccccc8)c(C#Cc8ccccc8)c5)(C7)C6)c4)(C1)CC(c1cc(C#Cc4ccccc4)c(C#Cc4ccccc4)c(C#Cc4ccccc4)c1)(C2)C3

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.33
APP P05067 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ICMT O60725 1/20 0.30

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
SCHEMBL2763025 0.92 APP (0.33) APPKDM4EMEN1NPC1ALDH1A1
SCHEMBL2763187 0.88 KCNH2 (0.34) KCNH2APPKDM4EMEN1NPC1
SCHEMBL2764292 0.86 KCNH2 (0.37) KCNH2APPKDM4EMEN1NPC1
SCHEMBL2763071 0.82 APP (0.34) APPKDM4EMEN1NPC1ALDH1A1
SCHEMBL2763805 0.82 RARB (0.35) KCNH2APPCYP3A4
SCHEMBL2763069 0.81 GRIN2D (0.43) KCNH2ALDH1A1
SCHEMBL2763858 0.77 APP (0.38) KCNH2APPNPC1CYP3A4MAPT
SCHEMBL2763104 0.77 APP (0.32) APPKDM4EMEN1NPC1ALDH1A1
SCHEMBL2846334 0.74 RARB (0.36) APPKDM4EMEN1NPC1ALDH1A1
SCHEMBL2187490 0.73 APP (0.36) KCNH2APPNPC1MAPT

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-8530596-B2 Polymer for forming insulating film, composition for forming insulating film, insulating film, and electronic device having same SUMITOMO BAKELITE CO., LTD. (JP) 2013-09-10 US disclosed
US-20100130672-A1 POLYMER FOR FORMING INSULATING FILM, COMPOSITION FOR FORMING INSULATING FILM, INSULATING FILM, AND ELECTRONIC DEVICE HAVING SAME SUMITOMO BAKELITE CO., LTD. (JP) 2010-05-27 US disclosed
EP-2177545-A1 POLYMER FOR FORMING INSULATING FILM, COMPOSITION FOR FORMING INSULATING FILM, INSULATING FILM, AND ELECTRONIC DEVICE HAVING INSULATING FILM Sumitomo Bakelite Company Limited (JP) 2010-04-21 EP disclosed