SCHEMBL4737482

SCHEMBL4737482

CCCCP(CCCC)(CCCC)(CCCC)OS(=O)(=O)c1ccc(Oc2cc(C(=O)OC)cc(C(=O)OC)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP2C9 P11712 1/20 0.37
MGLL Q99685 1/20 0.36
KDM4E B2RXH2 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
USP10 Q14694 1/20 0.35
GCK P35557 2/20 0.35
NPC1 O15118 1/20 0.35
CASP1 P29466 1/20 0.35
RAB9A P51151 1/20 0.35
TCF4 P15884 1/20 0.35
CTNNB1 P35222 1/20 0.35
EGFR P00533 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL4739947 0.88 POLB (0.41) USP2ALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL3686362 0.85 LMNA (0.40) ALDH1A1LMNAMEN1MAPTKMT2A
SCHEMBL11514902 0.82 LMNA (0.38) ALDH1A1LMNAMAPTMGLLKDM4E
SCHEMBL3902217 0.81 L3MBTL1 (0.37) ALDH1A1LMNAMEN1MAPTKMT2A
SCHEMBL3913167 0.79 LOX (0.45) ALDH1A1MAPTKMT2AKDM4EL3MBTL1
SCHEMBL3906043 0.76 L3MBTL1 (0.44) ALDH1A1LMNAMEN1KMT2ACYP2C9
SCHEMBL4737478 0.76 MMP13 (0.42) USP2ALDH1A1MEN1MAPTKMT2A
SCHEMBL472700 0.75 USP2 (0.49) USP2ALDH1A1SMN1; SMN2LMNAKMT2A
SCHEMBL6430764 0.75 USP2 (0.49) USP2ALDH1A1SMN1; SMN2LMNAKMT2A
SCHEMBL11681887 0.74 CA12 (0.43) SMN1; SMN2KMT2ACYP2C9NPC1RAB9A

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-2008085852-A1 USE OF COPOLYMERIZABLE SULFONATE SALTS TO PROMOTE CHAR FORMATION IN POLYESTERS AND COPOLYESTERS EASTMAN CHEMICAL COMPANY (US) 2008-07-17 WO disclosed