SCHEMBL12377692

SCHEMBL12377692

CC[n+]1c2ccccc2nc2c(OCCCC(=O)NCCOCCOCCOCCOCCC(=O)O)cccc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
LMNA P02545 2/20 0.40
ACKR3 P25106 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 2/20 0.38
HPGD P15428 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HIF1A Q16665 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
EPOR P19235 1/20 0.36
ACHE P22303 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35

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
SCHEMBL12377696 0.95 SMN1; SMN2 (0.41) MAPTLMNAACKR3SMN1; SMN2ALDH1A1
SCHEMBL15255324 0.92 MAPT (0.39) MAPTLMNAACKR3SMN1; SMN2ALDH1A1
SCHEMBL12377694 0.85 LTB4R (0.42) LMNAALDH1A1MEN1KMT2AHIF1A
SCHEMBL18803964 0.84 MAPT (0.40) MAPTLMNAACKR3SMN1; SMN2ALDH1A1
SCHEMBL18803962 0.83 ACKR3 (0.39) MAPTLMNAACKR3SMN1; SMN2ALDH1A1
Acetic Acid SCHEMBL1258679 0.83 LTB4R (0.41) LMNAACKR3ALDH1A1MEN1KMT2A
SCHEMBL15255335 0.82 MAPT (0.34) MAPTLMNAACKR3SMN1; SMN2ALDH1A1
Acetic Acid SCHEMBL1258682 0.81 LTB4R (0.40) LMNAACKR3ALDH1A1MEN1KMT2A
SCHEMBL18803958 0.81 FOLH1 (0.42) ACKR3ALDH1A1
SCHEMBL1258702 0.81 LTB4R (0.39) LMNAALDH1A1MEN1KMT2AHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8535511-B2 Methods for electrochemical analysis using matrix compositions with alkylphenazine quaternary salt and a nitrosoaniline ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2013-09-17 US disclosed
US-8008037-B2 Matrix composition with alkylphenazine quaternary salt and a nitrosoaniline ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2011-08-30 US disclosed
US-8008037-B2 Matrix composition with alkylphenazine quaternary salt and a nitrosoaniline ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2011-08-30 US disclosed
US-20090246808-A1 BIOSENSOR WITH IMPROVED ANALYTE SPECIFICITY ROCHE DIABETES CARE, INC. 2009-10-01 US disclosed
US-20090246808-A1 BIOSENSOR WITH IMPROVED ANALYTE SPECIFICITY ROCHE DIABETES CARE, INC. 2009-10-01 US disclosed