SCHEMBL27673146

SCHEMBL27673146

Cn1c2ccccc2c2c(-c3ccccc3O)ccc(N)c21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
MAPT P10636 4/20 0.43
RET P07949 1/20 0.42
HTT P42858 3/20 0.42
ALDH1A1 P00352 4/20 0.40
KEAP1 Q14145 3/20 0.40
NFE2L2 Q16236 3/20 0.40
KMT2A Q03164 3/20 0.40
HPGD P15428 3/20 0.40
MEN1 O00255 2/20 0.40
USP2 O75604 2/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
RECQL P46063 1/20 0.40
ATM Q13315 1/20 0.40
LIMK1 P53667 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38

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
SCHEMBL3874966 0.83 KDM4E (0.49) KDM4EMAPTRETHTTALDH1A1
SCHEMBL27673143 0.82 RET (0.60) KDM4EMAPTRETHTTALDH1A1
SCHEMBL3873231 0.80 KDM4E (0.55) KDM4EMAPTRETALDH1A1KEAP1
SCHEMBL27673102 0.80 KDM4E (0.47) KDM4EMAPTRETHTTALDH1A1
SCHEMBL27653184 0.79 KDM4E (0.46) KDM4EMAPTRETHTTALDH1A1
SCHEMBL27653133 0.79 MAPT (0.61) KDM4EMAPTRETHTTALDH1A1
SCHEMBL28762589 0.78 HSP90AA1 (0.47) KDM4EMAPTRETHTTALDH1A1
SCHEMBL27653103 0.78 MAPT (0.50) KDM4EMAPTRETHTTALDH1A1
SCHEMBL27673141 0.77 IDO1 (0.49) KDM4EMAPTHTTALDH1A1KMT2A
SCHEMBL27653159 0.77 MAPT (0.49) KDM4EMAPTHTTALDH1A1KMT2A

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-1937994-A Keratin dyeing compounds, keratin dyeing compositions containing them and their use PROCTER & GAMBLE (US) 2007-03-28 CN disclosed