SCHEMBL27653085

SCHEMBL27653085

Cn1c2ccccc2c2cc(-c3ccc(O)cc3)c(N)cc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.54
GPR3 P46089 1/20 0.46
RET P07949 1/20 0.45
KDM4E B2RXH2 4/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
HPGD P15428 4/20 0.41
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
HSD17B10 Q99714 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KIF11 P52732 1/20 0.40
CHEK1 O14757 1/20 0.40

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
SCHEMBL27653115 0.94 PABPC1 (0.50) PABPC1GPR3RETKDM4ERXRA
SCHEMBL27673088 0.82 MAPT (0.46) PABPC1KDM4EHPGDMAPTALDH1A1
SCHEMBL27653088 0.81 PABPC1 (0.55) PABPC1GPR3KDM4ERXRARXRB
SCHEMBL3879035 0.79 PABPC1 (0.62) PABPC1GPR3KDM4ERXRARXRB
SCHEMBL27673123 0.79 RXRA (0.62) PABPC1GPR3RETKDM4ERXRA
SCHEMBL3880532 0.78 PABPC1 (0.70) PABPC1GPR3KDM4ERXRARXRB
SCHEMBL27673127 0.77 MAPT (0.46) KDM4EHPGDMAPTALDH1A1HSD17B10
SCHEMBL27653208 0.76 RET (0.50) PABPC1GPR3RETKDM4ERXRA
SCHEMBL27673154 0.76 RET (0.50) PABPC1GPR3RETKDM4ERXRA
SCHEMBL27653116 0.75 PABPC1 (0.51) PABPC1GPR3KDM4ERXRARXRB

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