SCHEMBL21143591

SCHEMBL21143591

OB(O)Oc1ccc(F)cc1.[LiH]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 1/20 0.44
ORAI2 Q96SN7 1/20 0.44
ORAI3 Q9BRQ5 1/20 0.44
TRPV6 Q9H1D0 1/20 0.44
NFE2L2 Q16236 1/20 0.35
IDO1 P14902 2/20 0.34
TDO2 P48775 2/20 0.34
MAOB P27338 3/20 0.34
MAOA P21397 2/20 0.34
SOS1 Q07889 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
HSPB1 P04792 1/20 0.33
AOC2 O75106 1/20 0.33
DAO P14920 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NR4A2 P43354 1/20 0.32
APP P05067 1/20 0.32

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
SCHEMBL330747 0.97 ORAI1 (0.46) ORAI1ORAI2ORAI3TRPV6NFE2L2
SCHEMBL27765066 0.95 ORAI1 (0.44) ORAI1ORAI2ORAI3TRPV6NFE2L2
SCHEMBL21805853 0.95 ORAI1 (0.44) ORAI1ORAI2ORAI3TRPV6NFE2L2
Ammonia Solution, Strong SCHEMBL29013466 0.95 ORAI1 (0.44) ORAI1ORAI2ORAI3TRPV6NFE2L2
SCHEMBL27678323 0.95 ORAI1 (0.44) ORAI1ORAI2ORAI3TRPV6NFE2L2
Water SCHEMBL28143792 0.93 ORAI1 (0.42) ORAI1ORAI2ORAI3TRPV6NFE2L2
SCHEMBL28085559 0.91 SOS1 (0.44) ORAI1ORAI2ORAI3TRPV6SOS1
SCHEMBL1989896 0.91 ORAI1 (0.41) ORAI1ORAI2ORAI3TRPV6NFE2L2
SCHEMBL29222009 0.85 ORAI1 (0.37) ORAI1ORAI2ORAI3TRPV6NFE2L2
SCHEMBL3800806 0.84 CA1 (0.38)

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