SCHEMBL1798754

SCHEMBL1798754

CCCCCCCCCCCCc1cccc2ccccc12.CCCCCCCCCCCCc1cccc2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.55
BCHE P06276 1/20 0.51
MAPT P10636 2/20 0.50
KCNH2 Q12809 1/20 0.50
TLR8 Q9NR97 3/20 0.49
CYP1A2 P05177 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP2D6 P10635 1/20 0.48
CNR1 P21554 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
NQO2 P16083 1/20 0.47
CYP2C9 P11712 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47

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
SCHEMBL598700 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL422811 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL599120 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL284051 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL284581 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL284785 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL284530 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL283928 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL283950 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL283694 1.00 LIPG (0.55) LIPGBCHEMAPTKCNH2TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011066199-A1 INTERSTITIAL METAL HYDRIDE CATALYST ACTIVITY REGENERATION AND HYDROPROCESSING PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2011-06-03 WO claimed
WO-2011066198-A1 GROUP 13-15 INTERSTITIAL METAL HYDRIDE CATALYSTS AND ASSOCIATED PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2011-06-03 WO disclosed
WO-2011066199-A1 INTERSTITIAL METAL HYDRIDE CATALYST ACTIVITY REGENERATION AND HYDROPROCESSING PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2011-06-03 WO disclosed
WO-2011066207-A1 HIGH SEVERITY HYDROPROCESSING INTERSTITIAL METAL HYDRIDE CATALYSTS AND ASSOCIATED PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2011-06-03 WO disclosed
US-20110119990-A1 GROUP 13-15 INTERSTITIAL METAL HYDRIDE CATALYSTS AND ASSOCIATED PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANHY (US) 2011-05-26 US disclosed
US-20110119993-A1 HIGH SEVERITY HYDROPROCESSING INTERSTITIAL METAL HYDRIDE CATALYSTS AND ASSOCIATED PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2011-05-26 US disclosed