2-Methoxybenzaldehyde

2-Methoxybenzaldehyde

SCHEMBL8041437

COc1ccccc1C=O.NCC(N)C(=O)O

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.56
GRIK2 Q13002 1/20 0.56
GRIK3 Q13003 1/20 0.56
PTGDR2 Q9Y5Y4 1/20 0.48
NFE2L2 Q16236 2/20 0.47
TLR2 O60603 1/20 0.46
ERN1 O75460 1/20 0.46
TLR1 Q15399 1/20 0.46
TLR6 Q9Y2C9 1/20 0.46
TFEB P19484 1/20 0.45
LMNA P02545 5/20 0.44
MAPT P10636 2/20 0.44
NPC1 O15118 1/20 0.44
BCHE P06276 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
2-Methoxybenzaldehyde SCHEMBL8041436 1.00 GRIK1 (0.56) GRIK1GRIK2GRIK3PTGDR2NFE2L2
2-Methoxybenzaldehyde SCHEMBL8039080 0.85 GRIK1 (0.51) GRIK1GRIK2GRIK3PTGDR2NFE2L2
2-Methoxybenzaldehyde SCHEMBL8039077 0.85 GRIK1 (0.51) GRIK1GRIK2GRIK3PTGDR2NFE2L2
2-Methoxybenzaldehyde SCHEMBL8035615 0.83 PTGDR2 (0.58) GRIK1GRIK2GRIK3PTGDR2NFE2L2
2-Methoxybenzaldehyde SCHEMBL15106199 0.82 TLR2 (0.54) GRIK1GRIK2GRIK3PTGDR2NFE2L2
2-Methoxybenzaldehyde SCHEMBL28193905 0.79 LMNA (0.63) PTGDR2NFE2L2TLR2ERN1TLR1
SCHEMBL8035805 0.79 PTGDR2 (0.49) GRIK1GRIK2GRIK3PTGDR2TLR2
Salicyladehyde SCHEMBL8035808 0.79 TRIM24 (0.58) GRIK1GRIK2PTGDR2NFE2L2ERN1
Salicyladehyde SCHEMBL8035802 0.79 TRIM24 (0.58) GRIK1GRIK2PTGDR2NFE2L2ERN1
Dl-Phenylalanine SCHEMBL28274703 0.78 ERN1 (0.62) GRIK1GRIK2GRIK3TLR2ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6127381-A A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY LION BIOSCIENCE AG (DE) 2000-10-03 US disclosed