SCHEMBL8559544

SCHEMBL8559544

CN1Cc2ccc3ccccc3c2C(c2ccccc2)=N1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.36
EGFR P00533 2/20 0.35
ERBB2 P04626 2/20 0.35
HSD11B1 P28845 1/20 0.35
MAPT P10636 3/20 0.33
HRH4 Q9H3N8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP2C9 P11712 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL12786376 0.66 DRD2 (0.47) MAPTKDM4E
SCHEMBL12426595 0.65 MEN1 (0.43) MAPTKDM4E
SCHEMBL19797772 0.65 TMEM97 (0.40) WDR5MAPTKDM4E
SCHEMBL2689653 0.64 WDR5 (0.37) WDR5MAPTKDM4ENPC1LMNA
SCHEMBL12599451 0.63 KCNH2 (0.43) WDR5MAPTKDM4ECYP2C9
SCHEMBL12599868 0.63 CYP1A2 (0.49) MAPTKDM4ENPC1LMNARAB9A
SCHEMBL28896074 0.62 ALDH1A1 (0.48) WDR5MAPTKDM4ENPC1LMNA
SCHEMBL811240 0.62 TSHR (0.38) WDR5MAPTSMN1; SMN2
SCHEMBL22878699 0.62 EED (0.49) MAPTHRH4NPC1LMNARAB9A
SCHEMBL20528892 0.62 ALDH1A1 (0.38) WDR5MAPTKDM4ECYP2C9NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0475527-B1 Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents SANOFI SA (FR) 1998-02-25 EP disclosed
US-5624922-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1997-04-29 US disclosed
EP-0597540-B1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC (US) 1996-06-05 EP disclosed
US-5380721-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0597540-A1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1994-05-18 EP disclosed
EP-0475527-A2 Aryl-fused and hetaryl-fused-2, 4-diazepine and 2, 4-diazocine antiarrhythmic agents STERLING DRUG INC. (US) 1992-03-18 EP disclosed