SCHEMBL14920339

SCHEMBL14920339

O=C(/C=C\C(=O)OC(=O)c1ccccc1C(=O)O)OC(=O)c1ccccc1C(=O)O.[NaH].[NaH].[NaH].[NaH]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.55
HSD17B10 Q99714 5/20 0.55
HPGD P15428 4/20 0.55
MAPT P10636 2/20 0.55
ALDH1A1 P00352 8/20 0.54
ALOX15 P16050 1/20 0.54
AKR1C3 P42330 1/20 0.44
HMGB1 P09429 2/20 0.42
NAPRT Q6XQN6 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA7 P43166 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
POLB P06746 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
SCHEMBL297322 0.98 KDM4E (0.56) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL11799947 0.96 KDM4E (0.55) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL25290328 0.87 ALDH1A1 (0.48) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL33469 0.86 HCAR2 (0.50) KDM4EHSD17B10HPGDMAPTALDH1A1
Ethane SCHEMBL15524474 0.86 ALDH1A1 (0.47) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL16585286 0.86 ALDH1A1 (0.67) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL7030042 0.86 ALDH1A1 (0.67) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL6765311 0.84 ALDH1A1 (0.64) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL3229052 0.84 ALDH1A1 (0.64) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL248317 0.83 ALDH1A1 (0.70) KDM4EHSD17B10HPGDMAPTALDH1A1

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
EP-2780438-A1 A LIQUID HARD SURFACE ANTIMICROBIAL CLEANING COMPOSITION Unilever N.V. (NL) 2014-09-24 EP disclosed
EP-2773739-A1 A LIQUID HARD SURFACE ANTIMICROBIAL CLEANING COMPOSITION Unilever N.V. (NL) 2014-09-10 EP disclosed
EP-2773315-A2 A PERSONAL CLEANING COMPOSITION Unilever N.V. (NL) 2014-09-10 EP disclosed
CN-103890160-A A liquid hard surface antimicrobial cleaning composition UNILEVER NV 2014-06-25 CN disclosed
WO-2013064315-A1 A LIQUID HARD SURFACE ANTIMICROBIAL CLEANING COMPOSITION UNILEVER N.V. (NL) 2013-05-10 WO disclosed
WO-2013064360-A2 A PERSONAL CLEANING COMPOSITION UNILEVER N.V. (NL) 2013-05-10 WO disclosed
WO-2013064340-A1 A LIQUID HARD SURFACE ANTIMICROBIAL CLEANING COMPOSITION UNILEVER N.V. (NL) 2013-05-10 WO disclosed