N-Benzyl-4-Methoxyaniline

N-Benzyl-4-Methoxyaniline

SCHEMBL5765646

Br.COc1ccc(NCc2ccccc2)cc1

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of N-Benzyl-4-Methoxyaniline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.68
MAPT P10636 6/20 0.67
GAA P10253 4/20 0.67
L3MBTL1 Q9Y468 3/20 0.67
NPC1 O15118 2/20 0.67
RAB9A P51151 2/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
HTT P42858 2/20 0.61
FFAR1 O14842 1/20 0.60
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
LMNA P02545 1/20 0.58
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
TUBB4A P04350 1/20 0.58
TUBB P07437 1/20 0.58
TUBA3C P0DPH7 1/20 0.58
TUBA1B P68363 1/20 0.58

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
N-Benzyl-4-Methoxyaniline SCHEMBL1757104 0.98 HIF1A (0.69) HIF1AMAPTGAAL3MBTL1NPC1
SCHEMBL11192900 0.93 HIF1A (0.64) HIF1AMAPTGAAL3MBTL1NPC1
N-Benzyl-4-Methoxyaniline SCHEMBL30398333 0.91 HIF1A (0.62) HIF1AMAPTGAAL3MBTL1NPC1
N-Benzyl-4-Methoxyaniline SCHEMBL30398492 0.91 HIF1A (0.62) HIF1AMAPTGAAL3MBTL1NPC1
SCHEMBL2306553 0.91 HIF1A (0.74) HIF1AMAPTGAAL3MBTL1NPC1
Iodide SCHEMBL31325827 0.89 HIF1A (0.72) HIF1AMAPTGAAL3MBTL1NPC1
Hydrochloric Acid SCHEMBL29937106 0.89 HIF1A (0.72) HIF1AMAPTGAAL3MBTL1NPC1
SCHEMBL1844199 0.88 MAPT (0.82) HIF1AMAPTGAAL3MBTL1NPC1
SCHEMBL5669873 0.88 MAPT (0.82) HIF1AMAPTGAAL3MBTL1NPC1
SCHEMBL10055019 0.88 MAPT (0.82) HIF1AMAPTGAAL3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1693366-A1 Selective 5-HT 6 receptor ligands VIRGINIA COMMONWEALTH UNIVERSITY (US) 2006-08-23 EP disclosed
EP-1149078-B1 SELECTIVE 5-HT 6 RECEPTOR LIGANDS UNIV VIRGINIA COMMONWEALTH (US) 2006-03-08 EP disclosed
US-20040132800-A1 N-(2-arylethyl) benzylamines as antagonists of the 5-ht6 receptor CHEN ZHAOGEN (US) 2004-07-08 US disclosed
US-6518297-B2 Serotonin (5-HT) subtype 6 receptor (5-HT6); 3-(2-aminoethyl)indole derivatives; drug screening VIRGINIA COMMONWEALTH UNIVERSITY 2003-02-11 US disclosed
EP-1149078-A4 SELECTIVE 5-HT 6? RECEPTOR LIGANDS UNIV VIRGINIA COMMONWEALTH (US) 2003-01-29 EP disclosed
US-6489488-B2 SEROTONIN (5-HT) SUBTYPE 6 RECEPTOR (5-HT6); 3-(2-AMINOETHYL)INDOLE DERIVATIVES; DRUG SCREENING VIRGINIA COMMONWEALTH UNIVERSITY 2002-12-03 US disclosed
US-20020103382-A1 Selective 5-HT6 receptor ligands GLENNON RICHARD A (US) 2002-08-01 US disclosed
US-20020103383-A1 Selective 5-HT6 receptor ligands GLENNON RICHARD A (US) 2002-08-01 US disclosed
US-6403808-B1 TREATING MENTAL DISORDERS VIRGINIA COMMONWEALTH UNIVERSITY 2002-06-11 US disclosed
EP-1149078-A1 SELECTIVE 5-HT 6? RECEPTOR LIGANDS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2001-10-31 EP disclosed
WO-2000034242-A1 SELECTIVE 5-HT6 RECEPTOR LIGANDS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2000-06-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020103382-A1 Selective 5-HT6 receptor ligands HTR6, HTR4, HTR5A HIF1A 4730/4885MAPT 922/4885GAA 3346/4885
US-20040132800-A1 N-(2-arylethyl) benzylamines as antagonists of the 5-ht6 receptor HTR6, HTR1B, HTR1A HIF1A 3564/4885MAPT 3765/4885GAA 4258/4885
US-20020103383-A1 Selective 5-HT6 receptor ligands HTR6, HTR4, HTR5A HIF1A 4730/4885MAPT 922/4885GAA 3346/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.