SCHEMBL2732986

SCHEMBL2732986

CC1(CC2OCCO2)Cc2ccccc2C(=O)O1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.49
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 1/20 0.46
MAPK1 P28482 2/20 0.44
RAB9A P51151 1/20 0.44
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.42
TSHR P16473 2/20 0.41
UTS2R Q9UKP6 4/20 0.40
USP2 O75604 1/20 0.39
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL3971910 0.80 POLB (0.51) TP53POLBL3MBTL1LMNAMAPK1
SCHEMBL1110064 0.71 POLB (0.54) TP53POLBL3MBTL1LMNAMAPK1
SCHEMBL4256475 0.68 POLB (0.51) TP53POLBL3MBTL1LMNAMAPK1
SCHEMBL14919416 0.68 POLB (0.51) TP53POLBL3MBTL1LMNAMAPK1
SCHEMBL28668767 0.66 POLB (0.52) TP53POLBL3MBTL1LMNAMAPK1
SCHEMBL31098382 0.66 SMN1; SMN2 (0.50) LMNAMAPK1RAB9AMAPTTSHR
SCHEMBL16503885 0.64 POLB (0.47) TP53POLBL3MBTL1LMNAMAPK1
SCHEMBL28929688 0.63 MAPT (0.56) TP53POLBL3MBTL1LMNAMAPK1
SCHEMBL28670431 0.62 CFTR (0.50) TP53POLBL3MBTL1LMNAMAPK1
SCHEMBL28677624 0.62 UTS2R (0.57) TP53POLBL3MBTL1LMNAMAPK1

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
EP-2632465-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL Merck Sharp & Dohme Corp. (US) 2013-09-04 EP disclosed
WO-2012058116-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2012-05-03 WO disclosed