SCHEMBL8359335

SCHEMBL8359335

CCCCOc1cc(-n2cnc3cccc(C(=O)OC)c32)ccc1-c1ccccc1-c1nc(=O)s[nH]1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.36
FGFR1 P11362 3/20 0.35
SRC P12931 1/20 0.35
PDE5A O76074 3/20 0.34
DYRK1A Q13627 1/20 0.34
TLR7 Q9NYK1 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
AGTR1 P30556 1/20 0.33
AGTR2 P50052 1/20 0.33
CNR1 P21554 1/20 0.33
TLR8 Q9NR97 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
RIPK1 Q13546 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NR2E1 Q9Y466 1/20 0.32

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
SCHEMBL8357506 0.93 FGFR1 (0.36) FGFR1SRCPDE5ADYRK1AMEN1
SCHEMBL8361978 0.85 PLA2G2A (0.36) PLA2G2AFGFR1SRCPDE5ADYRK1A
SCHEMBL8364419 0.84 DYRK1A (0.34) FGFR1SRCDYRK1AESR1ESR2
SCHEMBL8364431 0.82 AGTR1 (0.35) PLA2G2AFGFR1SRCDYRK1AAGTR1
SCHEMBL8359535 0.81 FGFR1 (0.36) FGFR1SRCPDE5ADYRK1AMEN1
SCHEMBL8419025 0.80 FGFR1 (0.36) FGFR1SRCDYRK1AMEN1KMT2A
SCHEMBL8357460 0.80 TSHR (0.38) PDE5AMEN1KMT2AAGTR2
SCHEMBL8359337 0.80 PTPN11 (0.37) PDE5AALDH1A1
SCHEMBL8362079 0.79 AGTR1 (0.36) PLA2G2AFGFR1SRCDYRK1AAGTR1
SCHEMBL8711112 0.77 AGTR2 (0.44) FGFR1SRCAGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883111-A STRONG AND LONG-LASTING ACTION BY ORAL ADMINISTRATION; HYPOTENSIVE AGENTS; CARDIOTONIC AGENTS; ALZHEIMER'S DISEASE; TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-16 US disclosed
US-5736555-A HYPOTENSIVE AGENTS; FDA ORANGE BOOK LISTED PATENT FOR AZILSARTAN MEDOXOMIL TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-04-07 US disclosed