SCHEMBL2955973

SCHEMBL2955973

CN(c1ccccc1)c1ccc(O)cc1.Oc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 1/20 0.50
ALDH1A1 P00352 5/20 0.48
TSHR P16473 4/20 0.48
HSD17B10 Q99714 4/20 0.48
L3MBTL1 Q9Y468 4/20 0.48
ALOX12 P18054 3/20 0.48
MAPK1 P28482 2/20 0.48
ALOX15 P16050 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
PTGS1 P23219 1/20 0.48
SLC6A2 P23975 1/20 0.48
PTGS2 P35354 1/20 0.48
HTR2B P41595 1/20 0.48
S100B P04271 1/20 0.46
CYP3A4 P08684 3/20 0.46
HPGD P15428 3/20 0.45
KDM1A O60341 1/20 0.45
LMNA P02545 5/20 0.44
KMT2A Q03164 4/20 0.44
GAA P10253 3/20 0.44

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
SCHEMBL9782622 0.90 ALDH1A1 (0.59) NR3C2ALDH1A1TSHRHSD17B10L3MBTL1
SCHEMBL27315184 0.88 ALDH1A1 (0.62) NR3C2ALDH1A1TSHRHSD17B10L3MBTL1
SCHEMBL9513157 0.88 NR3C2 (0.60) NR3C2ALDH1A1TSHRHSD17B10L3MBTL1
SCHEMBL9480557 0.86 MEN1 (0.50) NR3C2ALDH1A1TSHRHSD17B10MAPK1
SCHEMBL2947867 0.86 MEN1 (0.50) NR3C2ALDH1A1TSHRHSD17B10MAPK1
Diphenylamine SCHEMBL2721122 0.86 HSD17B10 (0.60) NR3C2ALDH1A1TSHRHSD17B10L3MBTL1
SCHEMBL18432000 0.85 NR3C2 (0.53) NR3C2ALDH1A1TSHRHSD17B10L3MBTL1
SCHEMBL17703873 0.82 NR3C2 (0.55) NR3C2ALDH1A1TSHRHSD17B10L3MBTL1
SCHEMBL92754 0.82 ALDH1A1 (0.72) ALDH1A1TSHRHSD17B10L3MBTL1ALOX12
SCHEMBL585745 0.82 ALDH1A1 (0.72) ALDH1A1TSHRHSD17B10L3MBTL1ALOX12

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
US-7750156-B2 Method of producing aminophenol compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-07-06 US claimed