SCHEMBL16601562

SCHEMBL16601562

Cc1ccc([N+](=O)[O-])cc1Nc1ccc(ON)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
MAPT P10636 5/20 0.54
TDP1 Q9NUW8 3/20 0.54
MAPK1 P28482 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CTSV O60911 1/20 0.50
CTSL P07711 1/20 0.50
KMT2A Q03164 6/20 0.49
MEN1 O00255 5/20 0.49
POLB P06746 2/20 0.49
KAT2B Q92831 1/20 0.48
AKR1C3 P42330 1/20 0.47
AKR1C2 P52895 1/20 0.47
LMNA P02545 1/20 0.47
GFER P55789 2/20 0.47
GAA P10253 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ATM Q13315 1/20 0.47
TSHR P16473 2/20 0.46
CYP3A4 P08684 1/20 0.46

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
SCHEMBL9223332 0.79 ALDH1A1 (0.53) ALDH1A1MAPTTDP1MAPK1L3MBTL1
SCHEMBL26023168 0.78 ALDH1A1 (0.57) ALDH1A1MAPTTDP1MAPK1L3MBTL1
SCHEMBL16601555 0.77 RAPGEF4 (0.49) ALDH1A1MAPTTDP1L3MBTL1KMT2A
SCHEMBL31284756 0.74 LMNA (0.61) ALDH1A1MAPTTDP1L3MBTL1KMT2A
SCHEMBL11775750 0.74 LMNA (0.61) ALDH1A1MAPTTDP1L3MBTL1KMT2A
SCHEMBL7248489 0.74 MAPT (0.58) ALDH1A1MAPTTDP1MAPK1L3MBTL1
SCHEMBL435666 0.73 CA1 (0.59) ALDH1A1MAPTMAPK1KMT2AMEN1
Hydrochloric Acid SCHEMBL28061054 0.72 KAT2B (0.61) ALDH1A1MAPTTDP1L3MBTL1KMT2A
SCHEMBL4269161 0.72 EGFR (0.53) ALDH1A1MAPTTDP1MAPK1L3MBTL1
SCHEMBL1131511 0.72 ALDH1A1 (0.62) ALDH1A1MAPTTDP1L3MBTL1KMT2A

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-8993086-B2 Recordable optical recording medium TAIYO YUDEN CO., LTD. (JP) 2015-03-31 US disclosed