SCHEMBL4555964

SCHEMBL4555964

COc1ccc(N(C(=O)c2ccc3cn[nH]c3c2)c2ccc(C(C)(C)CNC(C)=O)c(Cl)c2)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.46
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
MAOA P21397 1/20 0.37
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.33
APAF1 O14727 1/20 0.33
MAPT P10636 1/20 0.33
MAP4K4 O95819 1/20 0.33
CLK2 P49760 1/20 0.33
DYRK1A Q13627 1/20 0.33
SRPK1 Q96SB4 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
POLB P06746 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
SCHEMBL4555962 0.81 MAOB (0.63) MAOBMAOAKDM4ENPC1LMNA
SCHEMBL2815607 0.69 POLB (0.54) KDM4ENPC1RAB9ASMN1; SMN2MEN1
SCHEMBL27796995 0.62 MAOB (0.60) MAOBMAOAKDM4ENPC1LMNA
SCHEMBL30715237 0.61 MAOB (0.51) MAOBKDM4ELMNAMEN1KMT2A
SCHEMBL347171 0.61 MAOB (0.55) MAOBKDM4ENPC1LMNARAB9A
SCHEMBL29643878 0.61 MAOB (0.55) MAOBKDM4ENPC1LMNARAB9A
SCHEMBL2818030 0.61 NTRK1 (0.52) MAOBKDM4ENPC1LMNARAB9A
SCHEMBL2817651 0.60 NR1H4 (0.44) MTNR1AMTNR1BMAOASMN1; SMN2MEN1
SCHEMBL2817492 0.60 POLB (0.54) KDM4ENPC1LMNARAB9ASMN1; SMN2
SCHEMBL2815379 0.60 POLB (0.54) KDM4ENPC1RAB9ASMN1; SMN2MEN1

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-2134676-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE Addex Pharma SA (CH) 2009-12-23 EP disclosed
WO-2008117175-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2008-10-02 WO disclosed