SCHEMBL9669404

SCHEMBL9669404

ClCCCCCc1c2ccccc2nc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.56
ALDH1A1 P00352 3/20 0.56
HPGD P15428 3/20 0.56
GAA P10253 2/20 0.56
TLR8 Q9NR97 6/20 0.47
MAOA P21397 2/20 0.45
MAOB P27338 1/20 0.45
HSD17B10 Q99714 3/20 0.43
CYP1A2 P05177 2/20 0.43
TSHR P16473 2/20 0.43
CYP3A4 P08684 1/20 0.43
KMT2A Q03164 2/20 0.43
CYP2D6 P10635 1/20 0.43
GLA P06280 3/20 0.42
ACHE P22303 2/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CHRM2 P08172 1/20 0.41
ADRA2A P08913 1/20 0.41

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
SCHEMBL29446778 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL321523 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL600971 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL599897 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL600275 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL194341 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL601351 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL194585 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL321157 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8
SCHEMBL320922 0.90 KDM4E (0.67) KDM4EALDH1A1HPGDGAATLR8

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
EP-0511366-A1 CHEMILUMINESCENT COMPOUNDS BECKMAN INSTRUMENTS, INC. (US) 1992-11-04 EP disclosed
WO-1992009580-A1 CHEMILUMINESCENT COMPOUNDS BECKMAN INSTRUMENTS, INC. (US) 1992-06-11 WO disclosed