SCHEMBL7536645

SCHEMBL7536645

O=C(O)c1ccc(C(=O)OCCO)cc1.O=C(O)c1ccc2ccccc2c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.43
NPC1 O15118 2/20 0.43
LDHA P00338 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.39
HSD17B10 Q99714 2/20 0.39
NR4A1 P22736 1/20 0.39
NR4A2 P43354 1/20 0.39
NR4A3 Q92570 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
CDC25B P30305 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38

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
SCHEMBL8416453 0.90 WDR5 (0.43) WDR5NPC1LDHATDP1LMNA
SCHEMBL3397194 0.87 WDR5 (0.50) WDR5LDHALMNAHSD17B10NR4A1
SCHEMBL8089174 0.87 WDR5 (0.46) WDR5NPC1LDHAHSD17B10NR4A1
Terephthalic Acid SCHEMBL7190729 0.87 WDR5 (0.53) WDR5LDHALMNAHSD17B10NR4A1
Terephthalic Acid SCHEMBL422894 0.84 WDR5 (0.59) WDR5LDHALMNAHSD17B10NR4A1
Di(Hydroxyethyl)Ether SCHEMBL8085670 0.83 WDR5 (0.51) WDR5LDHALMNAHSD17B10NR4A1
Benzoic Acid SCHEMBL4963616 0.81 WDR5 (0.59) WDR5LDHALMNAHSD17B10NR4A1
Ethylene Glycol SCHEMBL7538214 0.81 WDR5 (0.59) WDR5LDHALMNAHSD17B10NR4A1
Ethylene Glycol SCHEMBL3397199 0.81 WDR5 (0.59) WDR5LDHALMNAHSD17B10NR4A1
SCHEMBL8085666 0.80 WDR5 (0.42) WDR5NPC1LDHALMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020010285-A1 NOVEL POLYESTER AND PROCESS FOR PREPARING POLYESTER MITSUI CHEMICALS, INC. (JP) 2002-01-24 US claimed
EP-0939094-A2 Polyester and process for its preparation Mitsui Chemicals, Inc. (JP) 1999-09-01 EP claimed
US-6355738-B2 BLENDS; SOLID PHASE POLYMERIZATION MITSUI CHEMICALS INC (JP) 2002-03-12 US disclosed
US-20020010285-A1 NOVEL POLYESTER AND PROCESS FOR PREPARING POLYESTER MITSUI CHEMICALS, INC. (JP) 2002-01-24 US disclosed
EP-0939094-A3 Polyester and process for its preparation Mitsui Chemicals, Inc. (JP) 2001-01-31 EP disclosed
EP-0939094-A2 Polyester and process for its preparation Mitsui Chemicals, Inc. (JP) 1999-09-01 EP disclosed
EP-0939094-A2 Polyester and process for its preparation Mitsui Chemicals, Inc. (JP) 1999-09-01 EP disclosed