SCHEMBL8562483

SCHEMBL8562483

Cc1ccc(-c2ccccc2C(=O)C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
BCAT2 O15382 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
NPC1 O15118 1/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
AKR1C3 P42330 1/20 0.44
SLC6A3 Q01959 3/20 0.44
SLC6A4 P31645 2/20 0.44
POLB P06746 2/20 0.43
CYP2C19 P33261 1/20 0.43
CHRNB2 P17787 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA4 P43681 1/20 0.43
LTB4R2 Q9NPC1 1/20 0.43

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
SCHEMBL547673 0.86 BCAT2 (0.63) KMT2AMEN1SMN1; SMN2BCAT2GAA
SCHEMBL981885 0.86 CES2 (0.63) KMT2AMEN1SMN1; SMN2BCAT2CES2
SCHEMBL31402608 0.85 KMT2A (0.60) KMT2AMEN1SMN1; SMN2BCAT2NPC1
SCHEMBL372 0.85 KMT2A (0.60) KMT2AMEN1SMN1; SMN2BCAT2NPC1
Hydrochloric Acid SCHEMBL7610390 0.83 KMT2A (0.59) KMT2AMEN1SMN1; SMN2BCAT2NPC1
SCHEMBL16882044 0.82 KMT2A (0.48) KMT2AMEN1SMN1; SMN2BCAT2CES2
SCHEMBL7745951 0.81 CHEK1 (0.49) KMT2AMEN1SMN1; SMN2BCAT2NPC1
SCHEMBL5693606 0.80 AKR1C3 (0.61) KMT2AMEN1SMN1; SMN2BCAT2CES2
SCHEMBL27438916 0.80 HDAC7 (0.57) KMT2AMEN1SMN1; SMN2BCAT2CES2
SCHEMBL6004326 0.79 BCAT2 (0.71) KMT2AMEN1SMN1; SMN2BCAT2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0603001-B1 Biphenyl derivatives, their preparation and their use for the treatment of hypertension and cardiac disease SANKYO CO (JP) 1998-08-26 EP disclosed
US-5459148-A Cardiovascular disorders SANKYO COMPANY, LIMITED (JP) 1995-10-17 US disclosed
EP-0603001-A1 Biphenyl derivatives, their preparation and their use for the treatment of hypertension and cardiac disease SANKYO COMPANY LIMITED (JP) 1994-06-22 EP disclosed