SCHEMBL30067720

SCHEMBL30067720

O=[N+]([O-])c1cccc(NCCO)c1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.58
MEN1 O00255 2/20 0.58
POLB P06746 2/20 0.58
MAPT P10636 2/20 0.58
DDX3X O00571 1/20 0.58
HTT P42858 1/20 0.58
CTDSP1 Q9GZU7 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.55
PKM P14618 1/20 0.54
BLM P54132 1/20 0.53
ALDH1A1 P00352 3/20 0.52
HPGD P15428 1/20 0.52
ALOX12 P18054 1/20 0.52
LMNA P02545 1/20 0.52
TSHR P16473 1/20 0.52
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
MMP2 P08253 1/20 0.51

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
SCHEMBL3214047 1.00 KMT2A (0.58) KMT2AMEN1POLBMAPTDDX3X
Methoxymethane SCHEMBL28167006 0.94 KMT2A (0.54) KMT2AMEN1POLBMAPTDDX3X
SCHEMBL11115027 0.90 ALDH1A1 (0.57) KMT2AMEN1POLBMAPTDDX3X
SCHEMBL6226767 0.88 MAPT (0.53) KMT2AMEN1POLBMAPTDDX3X
SCHEMBL6231289 0.88 MAPT (0.53) KMT2AMEN1POLBMAPTDDX3X
SCHEMBL28807504 0.86 MAPT (0.62) KMT2AMEN1POLBMAPTDDX3X
SCHEMBL16943226 0.85 MAPT (0.56) KMT2AMEN1POLBMAPTDDX3X
SCHEMBL5112156 0.84 L3MBTL1 (0.55) KMT2AMEN1POLBMAPTDDX3X
SCHEMBL5167952 0.84 MAPT (0.55) KMT2AMEN1POLBMAPTDDX3X
SCHEMBL8223354 0.83 MEN1 (0.54) KMT2AMEN1POLBMAPTDDX3X

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4362906-A1 COMPOSITION COMPRISING SHEA, AN ALKYL(POLY)GLYCOSIDE, A POLYSACCHARIDE AND A DYE L'OREAL (FR) 2024-05-08 EP disclosed
EP-4362896-A1 COMPOSITION COMPRISING N,N-DICARBOXYMETHYLGLUTAMIC ACID, 1,3-PROPANEDIOL, AT LEAST ONE NONIONIC SURFACTANT, AT LEAST ONE ALKALINE AGENT AND/OR AT LEAST ONE DYE L'OREAL (FR) 2024-05-08 EP disclosed
EP-4362897-A1 COMPOSITION COMPRISING AT LEAST NONIONIC SURFACTANT, 1,3-PROPANEDIOL, AT LEAST ONE FATTY SUBSTANCE, AT LEAST ONE COLOURING AGENT L'OREAL (FR) 2024-05-08 EP disclosed
EP-4362892-A1 COMPOSITION COMPRISING AT LEAST ONE ALKYL (POLY)GLYCOSIDE, AT LEAST ONE FATTY ALCOHOL, AT LEAST ONE FATTY ACID, AND AT LEAST ONE ALKALINE AGENT L'OREAL (FR) 2024-05-08 EP disclosed
WO-2023118332-A1 COMPOSITION COMPRISING TWO POLYOLS DIFFERENT FROM ONE ANOTHER, AN ALKALINE AGENT AND A DYE L'OREAL (FR) 2023-06-29 WO disclosed
WO-2023275170-A1 COMPOSITION COMPRISING AT LEAST ONE ALKANOLAMINE, A (META)SILICATE, GLYCINE AND 1,3-PROPANEDIOL L'OREAL (FR) 2023-01-05 WO disclosed
WO-2023275204-A1 COMPOSITION COMPRISING AT LEAST ONE ALKYL (POLY)GLYCOSIDE, AT LEAST ONE FATTY ALCOHOL, AT LEAST ONE FATTY ACID, AND AT LEAST ONE ALKALINE AGENT L'OREAL (FR) 2023-01-05 WO disclosed
WO-2023275208-A1 COMPOSITION COMPRISING AT LEAST NONIONIC SURFACTANT, 1,3-PROPANEDIOL, AT LEAST ONE FATTY SUBSTANCE, AT LEAST ONE COLOURING AGENT L'OREAL (FR) 2023-01-05 WO disclosed
WO-2023275187-A1 COMPOSITION COMPRISING SHEA, AN ALKYL(POLY)GLYCOSIDE, A POLYSACCHARIDE AND A DYE L'OREAL (FR) 2023-01-05 WO disclosed
WO-2023275209-A1 COMPOSITION COMPRISING N,N-DICARBOXYMETHYLGLUTAMIC ACID, 1,3-PROPANEDIOL, AT LEAST ONE NONIONIC SURFACTANT, AT LEAST ONE ALKALINE AGENT AND/OR AT LEAST ONE DYE L'OREAL (FR) 2023-01-05 WO disclosed