SCHEMBL8700849

SCHEMBL8700849

N#Cc1ccc(C(c2ccc(-c3ccccc3)o2)n2cnnc2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
GRM5 P41594 1/20 0.34
FLT1 P17948 1/20 0.33
FLT4 P35916 1/20 0.33
KDR P35968 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
AR P10275 1/20 0.33
GABRG2 P18507 3/20 0.32
GABRB3 P28472 3/20 0.32
GABRA5 P31644 3/20 0.32
GABRA3 P34903 3/20 0.32
APLNR P35414 1/20 0.31
CYP19A1 P11511 3/20 0.31
SCD O00767 1/20 0.31
SCD5 Q86SK9 1/20 0.31
GABRA1 P14867 2/20 0.31
ACLY P53396 2/20 0.31
CYP17A1 P05093 1/20 0.31

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
SCHEMBL8702011 0.88 FLT1 (0.34) FNTAFNTBFLT1FLT4KDR
SCHEMBL8700590 0.87 CYP19A1 (0.44) FNTAFNTBMAPTHPGDCYP19A1
SCHEMBL8702874 0.85 IDO1 (0.35) CYP19A1CYP11B1CYP11B2
SCHEMBL8697636 0.81 CYP19A1 (0.45) FNTAFNTBMAPTHPGDGABRG2
SCHEMBL8697624 0.79 CYP19A1 (0.50) MAPTHPGDCYP19A1CYP17A1
SCHEMBL8703068 0.78 CYP19A1 (0.36) FNTAFNTBGRM5MAPTCYP19A1
SCHEMBL8698363 0.75 CYP19A1 (0.45) MAPTHPGDCYP19A1CYP17A1CYP11B1
SCHEMBL8700262 0.75 CYP19A1 (0.42) FNTAFNTBGRM5FLT1FLT4
SCHEMBL8697780 0.72 CYP19A1 (0.40) MAPTHPGDCYP19A1CYP17A1CYP11B1
SCHEMBL8699139 0.72 CYP19A1 (0.38) MAPTHPGDCYP19A1CYP17A1CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998018791-A1 HETEROCYCLIC FURAN COMPOUNDS, THEIR PREPARATION AND USE AS AROMATASE INHIBITORS A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1998-05-07 WO disclosed