SCHEMBL22468064

SCHEMBL22468064

CC1C[N+]([O-])(c2ccccc2)CCO1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
HTR1A P08908 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL22467911 0.79 ADRB2 (0.33) SLC6A2ADRA1AHTR2BSLC6A3CYP1A2
SCHEMBL22468063 0.76 ADRB2 (0.31) SLC6A2ADRA1AHTR2BSLC6A3CYP1A2
SCHEMBL9051047 0.74 CYP1A2 (0.44) CYP1A2CYP2C9
SCHEMBL22467977 0.73 GRM2 (0.38)
SCHEMBL22467943 0.72 EPHX1 (0.42) CYP1A2
SCHEMBL22467950 0.71 EPHX1 (0.45) CYP1A2
SCHEMBL3178242 0.66
SCHEMBL1828313 0.65 LMNA (0.33)
SCHEMBL11224081 0.65 LMNA (0.33)
SCHEMBL76560 0.63 LMNA (0.32)

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
US-11469448-B2 Electrolyte additive, electrolyte and lithium ion secondary battery containing the same MURATA MANUFACTURING CO., LTD. (JP) 2022-10-11 US disclosed
CN-111755749-A Electrolyte additive, electrolyte and lithium ion secondary battery comprising same 株式会社村田制作所 2020-10-09 CN disclosed
US-20200313239-A1 ELECTROLYTE ADDITIVE, ELECTROLYTE AND LITHIUM ION SECONDARY BATTERY CONTAINING THE SAME MURATA MANUFACTURING CO., LTD. (JP) 2020-10-01 US disclosed