SCHEMBL6989050

SCHEMBL6989050

COc1ccc2[nH]c(Cc3ccc(F)cc3)cc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.60
FLT3 P36888 2/20 0.52
HRH3 Q9Y5N1 3/20 0.50
AXL P30530 1/20 0.50
MTNR1A P48039 2/20 0.49
MTNR1B P49286 1/20 0.49
CNR2 P34972 1/20 0.48
AHR P35869 1/20 0.47
MAPT P10636 3/20 0.47
KDM4E B2RXH2 3/20 0.47
PDGFRB P09619 1/20 0.46
PDGFRA P16234 1/20 0.46
CNR1 P21554 1/20 0.45
KMT2A Q03164 2/20 0.45
USP2 O75604 1/20 0.45
POLB P06746 1/20 0.45
CASP1 P29466 1/20 0.45
PTPN7 P35236 1/20 0.45
BLM P54132 1/20 0.45
WRN Q14191 1/20 0.45

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
SCHEMBL6993755 0.86 LOXL2 (0.60) LOXL2FLT3HRH3AXLMTNR1A
SCHEMBL7415018 0.86 LOXL2 (0.60) LOXL2FLT3HRH3AXLMTNR1A
SCHEMBL10443687 0.85 LOXL2 (0.63) LOXL2FLT3HRH3AXLMTNR1A
SCHEMBL867547 0.85 LOXL2 (0.75) LOXL2FLT3HRH3AXLMTNR1A
SCHEMBL6995615 0.81 LOXL2 (0.57) LOXL2CNR2KDM4EHSD17B10NPC1
SCHEMBL6989299 0.78 LOXL2 (0.57) LOXL2CNR2MAPTKDM4ECNR1
SCHEMBL6995469 0.78 AHR (0.60) LOXL2FLT3AHRMAPTKDM4E
SCHEMBL6995767 0.78 AHR (0.67) LOXL2FLT3HRH3AXLMTNR1A
SCHEMBL2157095 0.77 LOXL2 (0.73) LOXL2FLT3HRH3AXLMTNR1A
SCHEMBL9515346 0.76 LOXL2 (0.67) LOXL2HRH3AXLMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1322646-A1 2-(1H-INDOL-3-YL)-2-OXO-ACETIC ACID AMIDES WITH ANTITUMOR ACTIVITY Novuspharma S.p.A. (IT) 2003-07-02 EP disclosed
EP-1244652-A1 2-(1H-INDOL-3-YL)-2-OXO-ACETAMIDES WITH ANTITUMOR ACTIVITY Cell Therapeutics Europe S.R.L. (IT) 2002-10-02 EP disclosed
WO-2002008225-A1 2-(1H-INDOL-3-YL)-2-OXO-ACETIC ACID AMIDES WITH ANTITUMOR ACTIVITY NOVUSPHARMA S.P.A. (IT) 2002-01-31 WO disclosed
WO-2001047916-A1 2-(1H-INDOL-3-YL)-2-OXO-ACETAMIDES WITH ANTITUMOR ACTIVITY NOVUSPHARMA S.P.A. (IT) 2001-07-05 WO disclosed