SCHEMBL24504697

SCHEMBL24504697

CSc1nsc(/N=N/c2ccc(O)c(C)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.49
MEN1 O00255 6/20 0.49
RAB9A P51151 4/20 0.49
NPC1 O15118 3/20 0.49
HSP90AA1 P07900 2/20 0.49
TDP1 Q9NUW8 4/20 0.39
ALDH1A1 P00352 4/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 2/20 0.36
LMNA P02545 2/20 0.36
BRD4 O60885 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL24504568 0.89 PTGS2 (0.39) KMT2AMEN1RAB9ANPC1HSP90AA1
SCHEMBL21278427 0.87 PMM2 (0.37) KMT2AMEN1RAB9ANPC1HSP90AA1
SCHEMBL18631945 0.85 PTGS1 (0.43) KMT2AMEN1RAB9ANPC1HSP90AA1
SCHEMBL16802936 0.85 PTGS1 (0.43) KMT2AMEN1RAB9ANPC1HSP90AA1
SCHEMBL22373634 0.81 BRD4 (0.38) MAPTBRD4CYP2C9MAPK1CYP2C19
SCHEMBL24504356 0.80 KMT2A (0.33) KMT2AMEN1RAB9ANPC1TDP1
SCHEMBL25925923 0.80 L3MBTL1 (0.35) KMT2AMEN1RAB9ANPC1HSP90AA1
SCHEMBL25925927 0.75 KMT2A (0.43) KMT2AMEN1RAB9ANPC1HSP90AA1
SCHEMBL6256568 0.74 KMT2A (0.71) KMT2AMEN1RAB9ANPC1HSP90AA1
SCHEMBL6256564 0.74 KMT2A (0.71) KMT2AMEN1RAB9ANPC1HSP90AA1

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
EP-2883531-B1 Bleaching and coloring composition for hair KAO CORP (JP) 2022-06-15 EP disclosed