SCHEMBL27673142

SCHEMBL27673142

Cc1cc(N)c2c(sc3ccccc32)c1-c1ccccc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
ALDH1A1 P00352 4/20 0.40
POLB P06746 2/20 0.40
ALOX5 P09917 1/20 0.40
HCRTR1 O43613 1/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PKM P14618 1/20 0.39
PTPN1 P18031 1/20 0.37
LIMK1 P53667 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36
PARP14 Q460N5 1/20 0.35
SLC9A1 P19634 2/20 0.35
PRKDC P78527 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33

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
SCHEMBL3877515 0.80 PKM (0.53) MAPTALDH1A1POLBHCRTR1LMNA
SCHEMBL27673165 0.77 MAPT (0.41) MAPTALDH1A1POLBALOX5HCRTR1
SCHEMBL3887852 0.77 ALDH1A1 (0.41) MAPTALDH1A1POLBHCRTR1LMNA
SCHEMBL23690476 0.75 ALOX5 (0.43) MAPTALDH1A1POLBALOX5HCRTR1
SCHEMBL3874443 0.75 PKM (0.53) MAPTALDH1A1POLBHCRTR1LMNA
SCHEMBL3887742 0.73 ALDH1A1 (0.47) MAPTALDH1A1POLBALOX5HCRTR1
SCHEMBL3875198 0.72 MAPT (0.46) MAPTALDH1A1POLBALOX5HCRTR1
SCHEMBL3882583 0.71 ALDH1A1 (0.44) MAPTALDH1A1POLBHCRTR1LMNA
SCHEMBL3886209 0.70 IDO1 (0.47) MAPTALDH1A1POLBALOX5HCRTR1
SCHEMBL3876524 0.69 IDO1 (0.48) MAPTALDH1A1POLBALOX5HCRTR1

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