SCHEMBL6995529

SCHEMBL6995529

Fc1cccc(Cc2cc3cc(Br)ccc3[nH]2)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.44
PCSK9 Q8NBP7 2/20 0.44
DAO P14920 1/20 0.43
F2 P00734 3/20 0.43
IDO1 P14902 2/20 0.43
SLC6A4 P31645 1/20 0.43
HTR6 P50406 1/20 0.43
TDO2 P48775 1/20 0.42
MAOB P27338 1/20 0.41
CYP19A1 P11511 1/20 0.41
HCAR2 Q8TDS4 1/20 0.40
CNR1 P21554 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39

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
SCHEMBL28178529 0.83 F2 (0.58) EGFRF2IDO1CYP19A1CNR1
SCHEMBL6991621 0.82 PCSK9 (0.50) PCSK9DAOF2HCAR2
SCHEMBL8801543 0.81 PCSK9 (0.47) PCSK9DAOF2IDO1TDO2
SCHEMBL865591 0.79 CYP19A1 (0.50) F2IDO1TDO2CYP19A1
SCHEMBL6620032 0.77 DAO (0.43) EGFRPCSK9DAOF2IDO1
SCHEMBL6989926 0.75 LOXL2 (0.49) EGFRPCSK9DAOF2IDO1
SCHEMBL864817 0.72 PCSK9 (0.56) PCSK9DAOF2IDO1TDO2
SCHEMBL28129462 0.72 F2 (0.47) F2IDO1CYP19A1HCAR2
SCHEMBL6943878 0.72 DAO (0.40) DAOF2IDO1TDO2MAOB
SCHEMBL4735968 0.70 HDAC6 (0.50) DAOHCAR2

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