SCHEMBL2215938

SCHEMBL2215938

CCc1ccc(N)c(Cl)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.46
GABRB2 P47870 1/20 0.46
FEN1 P39748 1/20 0.41
POLB P06746 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
THRB P10828 1/20 0.36
APEX1 P27695 1/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
MCL1 Q07820 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTRC Q99895 1/20 0.35
ESR1 P03372 4/20 0.33
ESR2 Q92731 4/20 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
SCHEMBL21852155 0.80 POLB (0.40) GABRA1GABRB2POLBALDH1A1MAPT
SCHEMBL6564003 0.77 DDR1 (0.43) POLBALDH1A1MAPTMEN1NPC1
SCHEMBL15994814 0.77 GABRA1 (0.48) GABRA1GABRB2FEN1ALDH1A1MAPT
SCHEMBL20640459 0.77 POLB (0.38) POLBALDH1A1MAPTMEN1NPC1
SCHEMBL25457914 0.77 ALDH1A1 (0.38) POLBALDH1A1MAPTMEN1NPC1
SCHEMBL14370499 0.74 ERCC1 (0.45) GABRA1GABRB2CTRCESR1ESR2
SCHEMBL31569145 0.74 CTRC (0.38) GABRA1GABRB2POLBALDH1A1MAPT
SCHEMBL9410519 0.74 GABRA1 (0.44) GABRA1GABRB2CTRCPRKCI
SCHEMBL45861 0.74 GABRA1 (0.68) GABRA1GABRB2FEN1CTRCESR1
SCHEMBL9505579 0.73 GABRA1 (0.54) GABRA1GABRB2FEN1POLBESR1

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
EP-1473024-B1 Dyeing composition comprising 2-chloro 6-methyl 3-amino phenol OREAL (FR) 2011-07-27 EP claimed