SCHEMBL9437404

SCHEMBL9437404

CCN(CC)N(c1ccccc1)c1ccc(N=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
TSHR P16473 5/20 0.47
HSD17B10 Q99714 3/20 0.47
MAPK1 P28482 3/20 0.47
TP53 P04637 1/20 0.47
HIF1A Q16665 1/20 0.47
TDP1 Q9NUW8 2/20 0.40
HTT P42858 2/20 0.40
CYP3A4 P08684 1/20 0.40
GLA P06280 1/20 0.39
ALOX15 P16050 1/20 0.36
NR3C2 P08235 1/20 0.35
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
MAPT P10636 3/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
PTBP1 P26599 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL1685257 0.82 TSHR (0.46) ALDH1A1TSHRHSD17B10MAPK1TP53
SCHEMBL1031712 0.78 ALDH1A1 (0.54) ALDH1A1TSHRHSD17B10MAPK1TP53
SCHEMBL5953334 0.77 ALDH1A1 (0.46) ALDH1A1TSHRHSD17B10MAPK1TP53
SCHEMBL27774101 0.76 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10MAPK1TP53
SCHEMBL12060779 0.75 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10MAPK1TP53
SCHEMBL12060766 0.74 ALDH1A1 (0.55) ALDH1A1TSHRHSD17B10MAPK1TP53
Benzophenone SCHEMBL9593853 0.73 ALDH1A1 (0.56) ALDH1A1TSHRTDP1HTTGLA
SCHEMBL146443 0.72 ALDH1A1 (0.58) ALDH1A1TSHRHSD17B10MAPK1TP53
SCHEMBL6711036 0.72 TSHR (0.38) ALDH1A1TSHRHSD17B10MAPK1TP53
SCHEMBL5672791 0.71 ALDH1A1 (0.50) ALDH1A1TSHRHSD17B10MAPK1TP53

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-5318882-A Nitrosodiphenylamine compounds render dyes lightfast TAIYO YUDEN CO., LTD. (JP) 1994-06-07 US disclosed