SCHEMBL19999908

SCHEMBL19999908

C#CCOc1ncccc1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.39
HPGD P15428 5/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
LRRK2 Q5S007 1/20 0.37
ALDH1A1 P00352 6/20 0.35
DRD2 P14416 3/20 0.35
HTR2A P28223 2/20 0.35
POLB P06746 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 3/20 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
SCHEMBL249966 0.79 L3MBTL1 (0.49) SSTR4HPGDCYP1A2CYP2D6CYP2C9
SCHEMBL3660182 0.79 NPC1 (0.41) SSTR4HPGDCYP1A2CYP2D6CYP2C9
SCHEMBL3803808 0.76 NPC1 (0.43) SSTR4HPGDCYP1A2CYP2D6CYP2C9
SCHEMBL3432978 0.76 NPC1 (0.43) SSTR4HPGDCYP1A2CYP2D6CYP2C9
SCHEMBL564714 0.76 HPGD (0.43) SSTR4HPGDCYP1A2CYP2D6CYP2C9
SCHEMBL3082319 0.75 ALDH1A1 (0.48) SSTR4HPGDCYP1A2CYP2D6CYP2C9
SCHEMBL22470618 0.75 SSTR4 (0.46) SSTR4HTR2AKDM4ERECQL
SCHEMBL4034458 0.75 MAOB (0.51) CYP3A4NPC1RAB9AL3MBTL1
SCHEMBL8776855 0.75 MKNK1 (0.43) SSTR4HPGDCYP1A2CYP2D6CYP2C9
SCHEMBL3287339 0.75 SSTR4 (0.46) SSTR4HPGDCYP1A2CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3300157-B1 NON-AQUEOUS ELECTROLYTE ADDITIVE, NON-AQUEOUS ELECTROLYTE CONTAINING SAME FOR LITHIUM SECONDARY BATTERY, AND LITHIUM SECONDARY BATTERY LG CHEMICAL LTD (KR) 2019-10-16 EP disclosed
US-20180198157-A1 NON-AQUEOUS ELECTROLYTE ADDITIVE, AND NON-AQUEOUS ELECTROLYTE FOR LITHIUM SECONDARY BATTERY COMPRISING THE SAME AND LITHIUM SECONDARY BATTERY LG CHEM, LTD. (KR) 2018-07-12 US disclosed
EP-3300157-A2 NON-AQUEOUS ELECTROLYTE ADDITIVE, NON-AQUEOUS ELECTROLYTE CONTAINING SAME FOR LITHIUM SECONDARY BATTERY, AND LITHIUM SECONDARY BATTERY LG Chem, Ltd. (KR) 2018-03-28 EP disclosed