SCHEMBL28813595

SCHEMBL28813595

Cc1ccc(C(N)(O)C(C)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
LMNA P02545 4/20 0.40
KIF11 P52732 7/20 0.39
ADRA2A P08913 1/20 0.37
ADRA2C P18825 1/20 0.37
HIF1A Q16665 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
TP53 P04637 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
XBP1 P17861 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL28024684 0.89 CYP2D6 (0.46) KMT2ALMNAADRA2AADRA2CHIF1A
SCHEMBL6281493 0.76 TSHR (0.43) MEN1KMT2ALMNAKIF11SMN1; SMN2
SCHEMBL1153036 0.73 KCNA5 (0.54) MEN1KMT2ALMNAKIF11ADRA2A
SCHEMBL1153033 0.73 KCNA5 (0.54) MEN1KMT2ALMNAKIF11ADRA2A
SCHEMBL7207081 0.72 KIF11 (0.48) MEN1KMT2ALMNAKIF11SMN1; SMN2
SCHEMBL3367523 0.72 ADRA2A (0.45) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL16113940 0.71 UGT2B7 (0.51) MEN1KMT2AHIF1ACYP1A2CYP2D6
SCHEMBL28600445 0.71 CYP2D6 (0.42) KMT2ALMNAADRA2AADRA2CHIF1A
SCHEMBL16219565 0.70 MEN1 (0.42) MEN1KMT2ALMNAKIF11CYP2D6
SCHEMBL15306844 0.70 MEN1 (0.42) MEN1KMT2ALMNAKIF11CYP2D6

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
CN-114746069-A Three-step multi-tone hair dyeing method 汉高股份有限及两合公司 2022-07-12 CN claimed