SCHEMBL18722697

SCHEMBL18722697

COc1cccc(C2(c3cc(C)cc(OC)c3)c3cc(C)ccc3-c3ccc(C)cc32)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.49
KDM1A O60341 1/20 0.38
PDE4D Q08499 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
TP53 P04637 3/20 0.36
MAOB P27338 3/20 0.36
RAPGEF4 Q8WZA2 1/20 0.35
ALDH1A1 P00352 3/20 0.35
ALKBH3 Q96Q83 1/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 2/20 0.35
HPGD P15428 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
UTS2R Q9UKP6 1/20 0.35

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
SCHEMBL12374340 0.93 ACHE (0.52) ACHEKDM1APDE4DSMN1; SMN2TP53
SCHEMBL15854778 0.85 ALDH1A1 (0.39) ACHEPDE4DSMN1; SMN2TP53MAOB
SCHEMBL14191205 0.76 ESR1 (0.47) ACHEKDM1ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL12374341 0.76 ACHE (0.48) ACHEPDE4DTP53MAOBALKBH3
SCHEMBL13828491 0.74 ACHE (0.52) ACHEPDE4DALDH1A1ALKBH3KMT2A
SCHEMBL16167856 0.73 ACHE (0.45) ACHEPDE4DTP53MAOBALKBH3
SCHEMBL14584274 0.73 ESR1 (0.45) ACHEKDM1APDE4DSMN1; SMN2MAOB
SCHEMBL12374337 0.73 PTGS2 (0.36) SMN1; SMN2TP53SLC6A2NPC1NFKB1
SCHEMBL12374331 0.72 PDK2 (0.40) ALDH1A1KMT2AL3MBTL1MEN1GAA
SCHEMBL21258346 0.72 NPSR1 (0.48) ACHESMN1; SMN2KMT2AKDM4EMEN1

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
US-9617468-B2 Luminescent composition and light-emitting element using said composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-11 US disclosed