SCHEMBL27669331

SCHEMBL27669331

O=C(O)Cc1ccc(-c2cc(Cl)ccc2O)o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.52
HPGD P15428 3/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
HTT P42858 2/20 0.46
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
GFER P55789 1/20 0.46
EPHX2 P34913 1/20 0.45
CA2 P00918 2/20 0.45
CA1 P00915 1/20 0.45
HPSE Q9Y251 1/20 0.44
PIK3CA P42336 1/20 0.43
PIK3CG P48736 1/20 0.43
POLB P06746 1/20 0.42
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 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
SCHEMBL27649079 0.79 SLC9A1 (0.57) SLC9A1HPGDALDH1A1MAPTHTT
SCHEMBL27649028 0.77 SOS1 (0.57) SLC9A1HPGDALDH1A1MAPTHTT
SCHEMBL27669358 0.75 ALDH1A1 (0.59) SLC9A1HPGDALDH1A1MAPTKDM4E
SCHEMBL6010133 0.72 SLC9A1 (0.51) SLC9A1HPGDALDH1A1MAPTHTT
SCHEMBL6010140 0.72 PIK3CA (0.57) SLC9A1HPGDALDH1A1MAPTHTT
SCHEMBL4943019 0.72 SLC9A1 (0.61) SLC9A1HPGDALDH1A1MAPTKDM4E
SCHEMBL27669329 0.71 SLC9A1 (0.50) SLC9A1HPGDALDH1A1MAPTKDM4E
SCHEMBL6285036 0.70 CA2 (0.48) HPGDALDH1A1MAPTHTTKDM4E
SCHEMBL4720637 0.70 SHMT1 (0.56) HPGDALDH1A1MAPTKDM4ELMNA
SCHEMBL3141863 0.70 HIF1A (0.61) HPGDMAPTHTTKDM4ECA2

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
CN-100519544-C Furancarbonylguanidine derivatives, their preparation and pharmaceutical compositions containing them KOREA INST OF CHEMISTRY KUL KU (KR) 2009-07-29 CN disclosed
CN-1902188-A Furancarbonylguanidine derivatives, their preparation and pharmaceutical compositions containing them KOREA RES INST CHEM TECH (KR) 2007-01-24 CN disclosed