SCHEMBL6573847

SCHEMBL6573847

Nc1cccc(O)c1NC(=O)Cn1cc[n+](CC(=O)Nc2c(N)cccc2O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
RECQL P46063 1/20 0.42
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
LMNA P02545 3/20 0.36
MAPT P10636 6/20 0.33
ALDH1A1 P00352 5/20 0.33
MAPK1 P28482 4/20 0.33
POLB P06746 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C19 P33261 2/20 0.33
RAB9A P51151 1/20 0.33
UBE2N P61088 2/20 0.32
HPGD P15428 4/20 0.32
PKM P14618 1/20 0.31

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 SCHEMBL6574924 0.99 KMT2A (0.41) MEN1KMT2ARECQLCA12CA1
SCHEMBL6945490 0.85 LMNA (0.41) MEN1KMT2ARECQLCA12CA1
Hydrochloric Acid SCHEMBL6942128 0.84 LMNA (0.41) MEN1KMT2ARECQLCA12CA1
SCHEMBL6575589 0.83 MEN1 (0.37) MEN1KMT2ARECQLLMNAMAPT
Hydrochloric Acid SCHEMBL7636177 0.83 KMT2A (0.39) MEN1KMT2ARECQLCA12CA1
Hydrochloric Acid SCHEMBL6571648 0.82 MEN1 (0.36) MEN1KMT2ARECQLLMNAMAPT
SCHEMBL6574287 0.81 KMT2A (0.48) MEN1KMT2ARECQLLMNAMAPT
Hydrochloric Acid SCHEMBL6572793 0.80 KMT2A (0.47) MEN1KMT2ARECQLLMNAMAPT
Bromide SCHEMBL22408334 0.80 CA12 (0.47) MEN1KMT2ARECQLCA12CA1
SCHEMBL6946221 0.79 KMT2A (0.51) MEN1KMT2ALMNAMAPTALDH1A1

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 2 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-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