SCHEMBL27673100

SCHEMBL27673100

Cc1cc(-c2ccc(O)cc2)c2c3ccccc3n(C)c2c1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.56
KDM4E B2RXH2 3/20 0.46
MAPT P10636 1/20 0.46
ALKBH5 Q6P6C2 1/20 0.40
FTO Q9C0B1 1/20 0.40
HSD17B10 Q99714 2/20 0.40
NQO2 P16083 1/20 0.39
LIMK1 P53667 2/20 0.38
HSD11B1 P28845 1/20 0.36
GABRP O00591 2/20 0.36
GABRD O14764 2/20 0.36
GABRA1 P14867 2/20 0.36
GABRB1 P18505 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRA3 P34903 2/20 0.36
GABRA2 P47869 2/20 0.36
GABRB2 P47870 2/20 0.36
GABRA4 P48169 2/20 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
SCHEMBL27673102 0.83 KDM4E (0.47) RETKDM4EMAPTALKBH5FTO
SCHEMBL3874031 0.81 KDM4E (0.53) RETKDM4EMAPTALKBH5FTO
SCHEMBL27673143 0.80 RET (0.60) RETKDM4EMAPTALKBH5FTO
SCHEMBL27653208 0.77 RET (0.50) RETKDM4EMAPTHSD17B10HSD11B1
SCHEMBL27653183 0.77 RET (0.47) RETKDM4EMAPTALKBH5FTO
SCHEMBL28762588 0.76 RET (0.51) RETKDM4EMAPTALKBH5FTO
SCHEMBL27653101 0.76 RET (0.51) RETKDM4EMAPTHSD17B10NQO2
SCHEMBL27673154 0.75 RET (0.50) RETKDM4EMAPTALKBH5FTO
SCHEMBL27046198 0.73 RET (0.57) RETKDM4EMAPTALKBH5FTO
SCHEMBL3877123 0.72 KDM4E (0.56) KDM4EMAPTALKBH5FTOHSD17B10

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