SCHEMBL6989797

SCHEMBL6989797

N#Cc1ccc2[nH]c(Cc3ccc(Cl)cc3)cc2c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.58
DRD4 P21917 6/20 0.58
DRD3 P35462 6/20 0.58
LOXL2 Q9Y4K0 1/20 0.45
CYP19A1 P11511 2/20 0.44
IDH1 O75874 4/20 0.43
IMPDH2 P12268 1/20 0.41
IMPDH1 P20839 1/20 0.41
SIRT1 Q96EB6 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
F2 P00734 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
PCSK9 Q8NBP7 1/20 0.39
CHEK1 O14757 1/20 0.38

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
SCHEMBL5794338 0.85 CYP19A1 (0.57) DRD2DRD4DRD3CYP19A1IMPDH2
SCHEMBL6990646 0.85 DRD2 (0.49) DRD2DRD4DRD3LOXL2CYP19A1
SCHEMBL6826452 0.83 LOXL2 (0.64) LOXL2CYP19A1SIRT1F2PCSK9
SCHEMBL3260101 0.81 DRD2 (0.49) DRD2DRD4DRD3CYP19A1F2
SCHEMBL6991388 0.78 LOXL2 (0.49) DRD2DRD4DRD3LOXL2F2
SCHEMBL6984195 0.78 LOXL2 (0.49) DRD2DRD4DRD3LOXL2SIRT1
SCHEMBL9530334 0.78 MEN1 (0.49) LOXL2SIRT1F2PCSK9
SCHEMBL6989926 0.78 LOXL2 (0.49) LOXL2CYP19A1SIRT1F2PCSK9
SCHEMBL6994727 0.78 LOXL2 (0.57) LOXL2SIRT1F2PCSK9
SCHEMBL9534394 0.78 LOXL2 (0.40) DRD2DRD4DRD3LOXL2SIRT1

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