SCHEMBL5013380

SCHEMBL5013380

O=C(CCCCCCCCC(=O)OC(=O)c1cccc(C(=O)O)c1)OC(=O)c1cccc(C(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA6 P23280 1/20 0.43
CA9 Q16790 1/20 0.43
FOLH1 Q04609 1/20 0.42
AKR1C3 P42330 1/20 0.42
KMO O15229 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 1/20 0.41
NR4A2 P43354 1/20 0.41
LTB4R Q15722 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL7691875 0.98 CA12 (0.44) L3MBTL1TDP1LMNAMAPTCA12
SCHEMBL28276792 0.94 HDAC3 (0.45) LMNACA12CA1CA2CA6
SCHEMBL9248152 0.90 MEN1 (0.41) L3MBTL1TDP1LMNAMAPTCA12
SCHEMBL28372834 0.90 HDAC3 (0.51) L3MBTL1TDP1LMNAMAPTNR4A2
SCHEMBL29093964 0.90 HDAC3 (0.51) L3MBTL1TDP1LMNAMAPTNR4A2
Ethylene Glycol SCHEMBL28246774 0.90 HDAC3 (0.41) LMNACA12CA1CA2CA6
SCHEMBL8460241 0.88 HDAC3 (0.49) L3MBTL1TDP1LMNAMAPTNR4A2
SCHEMBL27818035 0.87 PLA2G4B (0.50) KMT2ALTB4RHTT
SCHEMBL28751309 0.85 KDM4E (0.44) L3MBTL1MAPTFOLH1HSD17B10KMT2A
SCHEMBL29026187 0.85 HDAC3 (0.44) L3MBTL1TDP1LMNAMAPTKMT2A

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
US-20080085959-A1 Polyester Colorant Concentrate AVIENT SWITZERLAND GMBH (CH) 2008-04-10 US claimed
US-20200216720-A1 POLYESTER PRESSURE-SENSITIVE ADHESIVE COMPOSITION, POLYESTER PRESSURE-SENSITIVE ADHESIVE, PRESSURE-SENSITIVE ADHESIVE SHEET AND OPTICAL MEMBER WITH PRESSURE-SENSITIVE ADHESIVE LAYER MITSUBISHI CHEMICAL CORPORATION (JP) 2020-07-09 US disclosed