SCHEMBL6988041

SCHEMBL6988041

Cc1cccc2cc(Cc3ccc(F)cc3)[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.45
DAO P14920 2/20 0.45
DDO Q99489 1/20 0.45
NR3C1 P04150 1/20 0.44
PGR P06401 1/20 0.44
NR3C2 P08235 1/20 0.44
PCSK9 Q8NBP7 2/20 0.42
GAA P10253 3/20 0.41
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 5/20 0.38
HSD17B10 Q99714 4/20 0.38
NPSR1 Q6W5P4 2/20 0.38
TSHR P16473 2/20 0.38
HPGD P15428 3/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
MGAM O43451 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36

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
SCHEMBL6989384 0.85 DAO (0.45) DAODDOPCSK9GAAALDH1A1
SCHEMBL8801253 0.85 DAO (0.45) DAODDOPCSK9ALDH1A1KDM4E
SCHEMBL6993937 0.76 DAO (0.45) NPY5RDAODDONR3C1PGR
SCHEMBL17345813 0.75 DAO (0.50) DAODDONR3C1PGRNR3C2
SCHEMBL6994522 0.74 LOXL2 (0.53) PCSK9
SCHEMBL24554892 0.74 DAO (0.53) DAODDONR3C1PGRNR3C2
SCHEMBL31501898 0.74 DAO (0.53) DAODDONR3C1PGRNR3C2
SCHEMBL694774 0.73 MGAM (0.45) NPY5RDAODDOGAAMGAM
SCHEMBL7406951 0.73 DAO (0.45) NPY5RDAODDONR3C1PGR
SCHEMBL11809545 0.71 DAO (0.46) DAODDOPCSK9ALDH1A1KDM4E

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