SCHEMBL8781816

SCHEMBL8781816

COC(OC)c1cccc(OC(=O)OC(C)(C)C)c1OC(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.39
▸ ELANE P08246 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ FABP4 P15090 1/20 0.33
▸ FABP5 Q01469 1/20 0.33
▸ MAPK1 P28482 1/20 0.32
▸ EPHX2 P34913 2/20 0.32
▸ PTPN1 P18031 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ SCN5A Q14524 1/20 0.31
▸ SCN9A Q15858 1/20 0.31
▸ SCN10A Q9Y5Y9 1/20 0.31
▸ NFE2L2 Q16236 1/20 0.31
▸ ITGA4 P13612 1/20 0.30
▸ ITGB7 P26010 1/20 0.30
▸ KDM1A O60341 1/20 0.30
▸ CA12 O43570 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30

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
SCHEMBL2221010 0.83 ELANE (0.49) HSD17B10ELANEKDM4EHPGDMAPK1
SCHEMBL9174313 0.79 PTGES (0.37) HSD17B10ELANEKDM4EHPGDEPHX2
SCHEMBL9791378 0.77 ELANE (0.46) HSD17B10ELANEKDM4EHPGDMAPK1
SCHEMBL9314061 0.75 SRC (0.39) HSD17B10ELANEKDM4EHPGDNFE2L2
SCHEMBL16785664 0.75 PTPN1 (0.46) HSD17B10ELANEKDM4EHPGDPTPN1
SCHEMBL8781901 0.74 SRC (0.42) HSD17B10ELANEKDM4EHPGDMAPK1
SCHEMBL4059205 0.73 ELANE (0.49) HSD17B10ELANEKDM4EHPGDMAPK1
SCHEMBL30711978 0.72 CA12 (0.48) HSD17B10ELANEKDM4EHPGDCA12
SCHEMBL29391949 0.72 CA12 (0.48) HSD17B10ELANEKDM4EHPGDCA12
SCHEMBL9174009 0.71 ELANE (0.42) HSD17B10ELANEKDM4EHPGDBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0003172-B2 The use of a deodorant detergent composition for suppressing human body malodour UNILEVER PLC (GB) 1997-03-19 — — EP claimed
EP-0003172-B1 The use of a deodorant detergent composition for suppressing human body malodour UNILEVER PLC (GB) 1987-10-07 — — EP claimed
US-5356752-A Compounds with acid-labile protective groups useful in positive-working radiation-sensitive mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-18 — — US disclosed
US-5354643-A Oligomeric compounds with acid-labile protective groups useful in positive-working radiation-sensitive mixture HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-11 — — US disclosed
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