SCHEMBL13864482

SCHEMBL13864482

CCN(Cc1cc([N+](=O)[O-])ccc1OC)C(C)=O

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.67
LMNA P02545 3/20 0.67
HPGD P15428 2/20 0.67
MAPT P10636 2/20 0.49
HTT P42858 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
CYP3A4 P08684 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.46
APOBEC3A P31941 1/20 0.46
APOBEC3G Q9HC16 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
SCHEMBL13864518 0.86 ALDH1A1 (0.54) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL1065612 0.82 ALDH1A1 (0.48) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL13864485 0.81 ALDH1A1 (0.55) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL8973475 0.80 TDP1 (0.62) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL13864484 0.79 ALDH1A1 (0.54) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL4524927 0.79 TDP1 (0.57) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL2061576 0.77 ALDH1A1 (0.53) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL215804 0.77 TDP1 (0.58) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL30780913 0.77 TDP1 (0.58) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL8964829 0.77 TDP1 (0.62) ALDH1A1LMNAHPGDMAPTHTT

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-7531298-B2 Silver halide color photosensitive material FUJIFILM CORPORATION (JP) 2009-05-12 US disclosed