SCHEMBL8079472

SCHEMBL8079472

CCNCCN(CC)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.49
APP P05067 3/20 0.48
KDM4E B2RXH2 1/20 0.47
CNR2 P34972 1/20 0.47
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
OPRM1 P35372 2/20 0.46
CHRM2 P08172 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
CHRM1 P11229 1/20 0.46
DRD1 P21728 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
ADRA1A P35348 1/20 0.46
DRD3 P35462 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KCNH2 Q12809 1/20 0.46
BCHE P06276 3/20 0.46
ACHE P22303 3/20 0.46

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
SCHEMBL9326853 0.90 APP (0.56) MAOBAPPOPRM1CHRM2HTR1A
SCHEMBL2538898 0.88 MEN1 (0.53) MAOBAPPKDM4ECNR2TSHR
SCHEMBL15466880 0.84 MAOB (0.50) MAOBAPPKDM4ECNR2TSHR
SCHEMBL11464709 0.83 MEN1 (0.50) KCNH2MEN1
SCHEMBL17346229 0.82 MAOB (0.43) MAOBAPPKDM4ECNR2TSHR
SCHEMBL8113477 0.82 MAOB (0.47) MAOBAPPKDM4EOPRM1BCHE
SCHEMBL15303616 0.82 APP (0.48) MAOBAPPCNR2OPRM1CHRM2
SCHEMBL7200272 0.82 APP (0.48) APPOPRM1CHRM2HTR1AADRA2A
SCHEMBL18657229 0.81 APP (0.50) MAOBAPPKDM4EOPRM1BCHE
SCHEMBL22873879 0.81 APP (0.49) MAOBAPPBCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6025489-A Tricyclic pteridinones and a process for their preparation SCHERING AKTIENGESELLSCHAFT (DE) 2000-02-15 US disclosed
EP-0429149-B1 Tricyclic pteridinones and a process for their preparation BERLEX LAB (US) 2000-01-05 EP disclosed
US-5854419-A Tricyclic pteridinones and a process for their preparation SCHERING AKTIENGESELLSCHAFT (DE) 1998-12-29 US disclosed
US-5602252-A Tricyclic pteridinones and a process for their preparation BERLEX LABORATORIES, INC. 1997-02-11 US disclosed
EP-0429149-A1 Tricyclic pteridinones and a process for their preparation BERLEX LABORATORIES, INC. (US) 1991-05-29 EP disclosed