SCHEMBL1603169

SCHEMBL1603169

COc1cc(C)c(C=O)o1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.33
KDM4E B2RXH2 5/20 0.33
TSHR P16473 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 4/20 0.33
HSD17B10 Q99714 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ERN1 O75460 1/20 0.32
LMNA P02545 1/20 0.31
CYP19A1 P11511 1/20 0.31
PRKDC P78527 1/20 0.31
CYP2A6 P11509 1/20 0.30
MCL1 Q07820 1/20 0.30
MAOA P21397 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
SCHEMBL28026992 0.82
SCHEMBL1603208 0.79 ALDH1A1 (0.37) ALDH1A1KDM4EHPGDLMNA
SCHEMBL27841861 0.79 KDM4E (0.37) ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL28124066 0.78 ALDH1A1 (0.38) ALDH1A1TSHRHPGDL3MBTL1
SCHEMBL1249501 0.77 KDM4E (0.41) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL27946853 0.77 CA9 (0.34) ALDH1A1KDM4ETSHRTDP1HPGD
Water SCHEMBL28878288 0.77 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDLMNA
SCHEMBL6626531 0.75
SCHEMBL27790160 0.74 ELANE (0.34) ALDH1A1TSHRL3MBTL1LMNAMAOA
SCHEMBL29164973 0.73 ALDH1A1 (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3728710-B1 A FIBRE FURANIX TECHNOLOGIES BV (NL) 2022-04-27 EP claimed
EP-3728710-A1 A FIBRE Furanix Technologies B.V (NL) 2020-10-28 EP claimed
CN-106957289-B A kind of method that one kettle way situ catalytic carbohydrate prepares furans ethers 厦门大学 2019-11-08 CN claimed
EP-3498699-A1 CHROMATOGRAPHY METHOD FOR THE PURIFICATION OF FURFURAL DERIVATIVES BASF SE (DE) 2019-06-19 EP claimed
CN-109705069-A A kind of preparation method of 2,5- furandicarboxylic acid 厦门大学 2019-05-03 CN claimed
CN-109666011-A A method of preparing 2,5- furandicarboxylic acid 厦门大学 2019-04-23 CN claimed
CN-108541276-A Based on the alcohol of furans via the selective oxidation of electrification technique 罗地亚经营管理公司 2018-09-14 CN claimed
CN-107205447-A Beverage precursor and the method for preparing beverage 奥驰亚客户服务有限责任公司 2017-09-26 CN claimed
CN-104209120-B Metal cluster that mesoporous zirconium silicon nanosphere is stable and preparation method and application 中国科学院大连化学物理研究所 2016-09-14 CN claimed
CN-105188420-A Flavor system and method for making beverages ALTRIA CLIENT SERVICES INC 2015-12-23 CN claimed
CN-104968652-A Catalyst and catalytic process for the etherification/reduction of furfuryl derivatives to tetrahydrofurfuryl ethers CONSEJO SUPERIOR INVESTIGACION 2015-10-07 CN claimed
CN-104209120-A Metal cluster with stable mesoporous zirconium silicon nanosphere, preparation method and application thereof DALIAN CHEMICAL PHYSICS INST 2014-12-17 CN claimed
US-20110082304-A1 METHOD FOR THE SYNTHESIS OF 5-HYDROXYMETHYLFURFURAL ETHERS AND THEIR USE FURANIX TECHNOLOGIES B.V. (NL) 2011-04-07 US claimed
EP-2004620-A2 METHOD FOR THE SYNTHESIS OF 5-ALKOXYMETHYL FURFURAL ETHERS AND THEIR USE Furanix Technologies B.V (NL) 2008-12-24 EP claimed
WO-2007104514-A2 METHOD FOR THE SYNTHESIS OF 5-ALKOXYMETHYL FURFURAL ETHERS AND THEIR USE FURANIX TECHNOLOGIES B.V. (NL) 2007-09-20 WO claimed
CN-115350255-A Traditional Chinese medicine formula for nourishing yin, suppressing yang, reducing phlegm and activating blood stasis and preparation process 周雪林 2022-11-18 CN disclosed
EP-3728710-B1 A FIBRE FURANIX TECHNOLOGIES BV (NL) 2022-04-27 EP disclosed
CN-1736460-A Anti-senium micro soft capsule and its preparation method GAO JUNSHAN (CN) 2006-02-22 CN disclosed
CN-1718234-A Compound glossy ganoderma tables, and its prepn. method GAO JUNSHAN (CN) 2006-01-11 CN disclosed
CN-1377608-A Miao nationality medicinal food series and its processing method YANG DANHUA (CN) 2002-11-06 CN disclosed