SCHEMBL21143589

SCHEMBL21143589

OB(O)Oc1ccccc1F.[LiH]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 1/20 0.42
PARP10 Q53GL7 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
ACHE P22303 1/20 0.37
RHEB Q15382 1/20 0.37
ALDH1A1 P00352 3/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
GAA P10253 1/20 0.36
ENPP2 Q13822 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ORAI1 Q96D31 1/20 0.34

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
SCHEMBL29364630 0.98 PARP10 (0.39) CXCL8PARP10L3MBTL1TDP1ACHE
SCHEMBL678440 0.98 PARP10 (0.39) CXCL8PARP10L3MBTL1TDP1ACHE
Pentane SCHEMBL6139807 0.85 L3MBTL1 (0.46) L3MBTL1TDP1KDM4ECYP1A2CYP2C9
Tromethamine SCHEMBL23467073 0.82 PARP10 (0.37) CXCL8PARP10L3MBTL1TDP1ALDH1A1
SCHEMBL31338564 0.81 ERN1 (0.36) PARP10L3MBTL1TDP1ACHEALDH1A1
SCHEMBL30673991 0.80 SLC6A2 (0.43) ACHERHEBKMT2AHTR1ASLC6A2
SCHEMBL2192714 0.80 SLC6A2 (0.43) ACHERHEBKMT2AHTR1ASLC6A2
SCHEMBL6678412 0.80 ENPP2 (0.44) TDP1ALDH1A1GAAENPP2MEN1
SCHEMBL29706601 0.80 ENPP2 (0.44) TDP1ALDH1A1GAAENPP2MEN1
SCHEMBL31112249 0.78 ERN1 (0.44) L3MBTL1TDP1RHEBALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107922549-B Polyolefin polymer composition as optical material 住友电木株式会社 2019-07-26 CN claimed
CN-107548405-B Chain transfer agent for addition bulk polymerization of polycycloolefinic monomers 住友电木株式会社 2018-12-14 CN claimed
CN-107922549-A Polyolefin polymer composition as optical material 普罗米鲁斯有限责任公司 2018-04-17 CN claimed
CN-107548405-A Chain transfer agent for addition bulk polymerization of polycycloolefinic monomers 普罗米鲁斯有限责任公司 2018-01-05 CN claimed
CN-107922549-B Polyolefin polymer composition as optical material 住友电木株式会社 2019-07-26 CN disclosed
US-20190218340-A1 BATTERY CASE, BATTERY, LIQUID CRYSTAL POLYMER, AND ARTICLE SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-07-18 US disclosed
CN-107548405-B Chain transfer agent for addition bulk polymerization of polycycloolefinic monomers 住友电木株式会社 2018-12-14 CN disclosed
CN-106574008-B Polycyclic alkene block polymer and the osmotic evaporation film being produced from it 住友电木株式会社 2018-06-19 CN disclosed
CN-107548405-A Chain transfer agent for addition bulk polymerization of polycycloolefinic monomers 普罗米鲁斯有限责任公司 2018-01-05 CN disclosed