SCHEMBL6574287

SCHEMBL6574287

O=C(Cn1cc[n+](CC(=O)Nc2ccccc2O)c1)Nc1ccccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
RECQL P46063 1/20 0.48
LMNA P02545 4/20 0.45
MAPK1 P28482 3/20 0.45
MAPT P10636 3/20 0.45
HPGD P15428 3/20 0.45
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM1A O60341 1/20 0.42
ACHE P22303 2/20 0.41
BACE1 P56817 1/20 0.41
AKR1B1 P15121 1/20 0.41
POLB P06746 1/20 0.40
BCHE P06276 1/20 0.39
GAA P10253 3/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39

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
Hydrochloric Acid SCHEMBL6572793 0.99 KMT2A (0.47) KMT2AMEN1RECQLLMNAMAPK1
SCHEMBL6573830 0.85 POLB (0.55) KMT2AMEN1RECQLLMNAMAPK1
Hydrochloric Acid SCHEMBL6572772 0.84 POLB (0.53) KMT2AMEN1RECQLLMNAMAPK1
SCHEMBL6943172 0.83 MAPT (0.49) KMT2AMEN1LMNAMAPK1MAPT
SCHEMBL6572672 0.83 HPGD (0.50) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL7805084 0.83 KMT2A (0.41) KMT2AMEN1RECQLLMNAMAPK1
SCHEMBL6573686 0.83 RAD52 (0.39) KMT2AMEN1RECQLLMNAMAPK1
Hydrochloric Acid SCHEMBL6572916 0.82 RAD52 (0.39) KMT2AMEN1RECQLLMNAMAPK1
SCHEMBL6572938 0.82 ALDH1A1 (0.54) KMT2AMEN1MAPK1MAPTALDH1A1
Hydrochloric Acid SCHEMBL7632996 0.82 KMT2A (0.41) KMT2AMEN1RECQLLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066263-B1 NOVEL CATIONIC 2-ACYLAMINOPHENOLS, THEIR USE AS COUPLER FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM, AND DYEING METHODS OREAL (FR) 2004-05-26 EP claimed
EP-1066263-A1 NOVEL CATIONIC 2-ACYLAMINOPHENOLS, THEIR USE AS COUPLER FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM, AND DYEING METHODS L'OREAL (FR) 2001-01-10 EP claimed
WO-2000043368-A1 NOVEL CATIONIC 2-ACYLAMINOPHENOLS, THEIR USE AS COUPLER FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM, AND DYEING METHODS L'OREAL (FR) 2000-07-27 WO claimed
EP-1066263-B1 NOVEL CATIONIC 2-ACYLAMINOPHENOLS, THEIR USE AS COUPLER FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM, AND DYEING METHODS OREAL (FR) 2004-05-26 EP disclosed
EP-1066263-A1 NOVEL CATIONIC 2-ACYLAMINOPHENOLS, THEIR USE AS COUPLER FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM, AND DYEING METHODS L'OREAL (FR) 2001-01-10 EP disclosed
WO-2000043368-A1 NOVEL CATIONIC 2-ACYLAMINOPHENOLS, THEIR USE AS COUPLER FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM, AND DYEING METHODS L'OREAL (FR) 2000-07-27 WO disclosed