SCHEMBL3249022

SCHEMBL3249022

COc1cc(-c2nc(-c3ccccc3Cl)n(-c3nc(-c4cc(OC)c(OC)c(OC)c4)c(-c4cc(OC)c(OC)c(OC)c4)n3-c3ccccc3Cl)c2-c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.47
PDE2A O00408 3/20 0.39
PDE10A Q9Y233 3/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 2/20 0.37
HTT P42858 1/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37

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
SCHEMBL3246792 0.80 BCHE (0.46) SMN1; SMN2ALDH1A1KMT2ALMNANPC1
SCHEMBL314366 0.73 PDGFRB (0.45) PDGFRBPDE2APDE10ASMN1; SMN2ALDH1A1
SCHEMBL29875596 0.73 PDGFRB (0.45) PDGFRBPDE2APDE10ASMN1; SMN2ALDH1A1
SCHEMBL22507458 0.72 BCHE (0.47) SMN1; SMN2ALDH1A1KMT2ALMNANPC1
SCHEMBL2323350 0.69 PDGFRB (0.54) PDGFRBSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL28767208 0.69 ALDH1A1 (0.54) PDE2APDE10ASMN1; SMN2ALDH1A1MEN1
SCHEMBL10071744 0.67 BCHE (0.54) CNR1SMN1; SMN2KMT2ATP53
SCHEMBL4205066 0.67 HSD11B1 (0.45) SMN1; SMN2ALDH1A1NPC1TP53TSHR
SCHEMBL16935813 0.67 TSHR (0.53) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL7044209 0.66 NPC1 (0.54) PDE2APDE10ASMN1; SMN2ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1553450-B1 Process for preparing plugged-through-hole printed wiring board and plugged-through-hole printed wiring board SAN EI KAGAKU CO (JP) 2010-05-26 EP disclosed