SCHEMBL226720

SCHEMBL226720

O=C(O)c1ccc(O)c(F)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.71
LMNA P02545 3/20 0.71
HSD17B10 Q99714 2/20 0.71
CA12 O43570 4/20 0.64
CA1 P00915 4/20 0.64
CA2 P00918 4/20 0.64
CA6 P23280 4/20 0.64
CA9 Q16790 4/20 0.64
CA4 P22748 3/20 0.64
CA7 P43166 3/20 0.64
CA14 Q9ULX7 3/20 0.64
MAPT P10636 2/20 0.64
POLB P06746 1/20 0.64
GAA P10253 1/20 0.64
PTGS2 P35354 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
P4HB P07237 1/20 0.59
HTT P42858 2/20 0.55
MAPK1 P28482 2/20 0.55
RAB9A P51151 1/20 0.55

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
SCHEMBL30574898 1.00 KDM4E (0.71) KDM4ELMNAHSD17B10CA12CA1
Water SCHEMBL4310345 0.98 KDM4E (0.69) KDM4ELMNAHSD17B10CA12CA1
SCHEMBL2649763 0.89 KDM4E (0.59) KDM4ELMNAHSD17B10CA12CA1
SCHEMBL3468841 0.88 KDM4E (0.68) KDM4ELMNAHSD17B10CA12CA1
SCHEMBL29748711 0.84 HSD17B1 (0.59) KDM4ELMNAHSD17B10P4HBSNCA
SCHEMBL27661242 0.84 HSD17B1 (0.59) KDM4ELMNAHSD17B10P4HBSNCA
SCHEMBL9437164 0.84 KDM4E (1.00) KDM4ELMNAHSD17B10CA12CA1
Deaminohydroxyvaline SCHEMBL7828384 0.83 KDM4E (0.53) KDM4ELMNAHSD17B10CA12CA1
SCHEMBL32257493 0.82 CA6 (0.64) KDM4ELMNAHSD17B10CA12CA1
SCHEMBL383555 0.82 CA6 (0.64) KDM4ELMNAHSD17B10CA12CA1

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 688 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-115722210-B Recursive nanofiber-based detection material and preparation method and application thereof 广西大学 2024-02-20 CN claimed
CN-116178685-A LCP material with high clearing point and preparation method thereof 宁夏清研高分子新材料有限公司 2023-05-30 CN claimed
CN-115722210-A Recursive nanofiber-based detection material and preparation method and application thereof 广西大学 2023-03-03 CN claimed
CN-113816940-A Nicotine salts, co-crystals and salt co-crystal complexes R.J.雷诺兹烟草公司 2021-12-21 CN claimed
CN-113754634-A Nicotine salts, co-crystals and salt co-crystal complexes R.J.雷诺兹烟草公司 2021-12-07 CN claimed
CN-109233936-B High-temperature-resistant polyester lubricating oil base oil and preparation method thereof 黄山学院 2021-10-15 CN claimed
CN-1636989-B Single reactors synthesis method of KOH-capped polyols based on DMC-synthesized intermediates BAYER MATERIALSCIENCE LLC 2011-04-13 CN claimed
US-7005552-B2 Single reactor synthesis of KOH-capped polyols based on DMC-synthesized intermediates BAYER MATERIALSCIENCE LLC (US) 2006-02-28 US claimed
CN-1636989-A Single reactors synthesis of KOH-capped polyols based on DMC-synthesized intermediates BAYER MATERIALSCIENCE LLC (US) 2005-07-13 CN claimed
US-20050096488-A1 Single reactor synthesis of KOH-capped polyols based on DMC-synthesized intermediates COVESTRO LLC 2005-05-05 US claimed
EP-1528073-A1 Single reactor synthesis of polyols capped using basic catalysts and being based on intermediates synthesized using DMC-catalysts Bayer MaterialScience LLC (US) 2005-05-04 EP claimed
EP-1183248-B1 NON-LINEAR OPTICAL DEVICES AND MATERIALS THEREFOR QINETIQ LTD (GB) 2003-06-18 EP claimed
JP-2002544546-A 2002-12-24 JP claimed
EP-1183248-A1 NON-LINEAR OPTICAL DEVICES AND MATERIALS THEREFOR QinetiQ Limited (GB) 2002-03-06 EP claimed
WO-2000068217-A1 NON-LINEAR OPTICAL DEVICES AND MATERIALS THEREFOR QINETIQ LIMITED (GB) 2000-11-16 WO claimed
EP-0461651-B1 Recording medium FUJI PHOTO FILM CO LTD (JP) 1994-02-16 EP claimed
JP-11080094-A None JP disclosed
CN-85107954-A benzoic acid derivatives and their preparation 1986-04-10 CN disclosed
EP-0106565-A1 Leukotriene antagonists, their production, and compositions containing them MERCK FROSST CANADA INC. (CA) 1984-04-25 EP disclosed