SCHEMBL8359207

SCHEMBL8359207

CN(C)c1ccccc1/C=C/c1cc[n+](C)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHAT P28329 8/20 0.60
RAB9A P51151 6/20 0.60
KDM4E B2RXH2 2/20 0.60
APOBEC3A P31941 1/20 0.60
APOBEC3G Q9HC16 1/20 0.60
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
MAPT P10636 3/20 0.54
ALDH1A1 P00352 3/20 0.54
LMNA P02545 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
ALPG P10696 1/20 0.54
THRB P10828 1/20 0.54
HTT P42858 1/20 0.54
GFER P55789 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
USP2 O75604 3/20 0.48
NPC1 O15118 2/20 0.48
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.44

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
SCHEMBL2845206 0.83 RELA (0.55) CHATAPP
SCHEMBL2845201 0.83 RELA (0.55) CHATAPP
SCHEMBL29808641 0.82 RELA (0.53) CHATAPP
SCHEMBL29523356 0.81 GSK3B (0.44) KDM4EMAPTALDH1A1LMNASMN1; SMN2
SCHEMBL2776332 0.79 APP (0.67) RAB9AKDM4EMEN1KMT2AMAPT
SCHEMBL2776337 0.79 APP (0.67) RAB9AKDM4EMEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL9052352 0.79 CHAT (0.38) CHATRAB9AKDM4EAPOBEC3AAPOBEC3G
Bromide SCHEMBL8666503 0.77 CHAT (0.40) CHATRAB9AKDM4EAPOBEC3AAPOBEC3G
SCHEMBL4072573 0.77 MAPT (0.55) RAB9AKDM4EMEN1KMT2AMAPT
Iodide SCHEMBL8702272 0.76 RAB9A (0.52) CHATRAB9AKDM4EAPOBEC3AAPOBEC3G

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-5856522-A Method of using synthesis of 1,2-dioxetanes and kits therefore TROPIX, INC. (US) 1999-01-05 US disclosed
US-5777133-A Synthesis of 1, 2-dioxetanes and intermediates therefor TROPIX, INC. (US) 1998-07-07 US disclosed
US-5679802-A 1,2-dioxetanes useful in chemiluminescent immunoassays TROPIX, INC. (US) 1997-10-21 US disclosed