SCHEMBL27970010

SCHEMBL27970010

O=[N+]([O-])c1cccc(NN(c2ccccc2)c2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
POLB P06746 3/20 0.48
TDP1 Q9NUW8 5/20 0.46
ALDH1A1 P00352 5/20 0.46
MAPK1 P28482 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CASP7 P55210 1/20 0.46
GPR35 Q9HC97 2/20 0.45
TSHR P16473 1/20 0.45
CXCR1 P25024 1/20 0.40
CXCR2 P25025 1/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 2/20 0.39
PKM P14618 1/20 0.39
KAT2B Q92831 1/20 0.38

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
SCHEMBL29771491 0.88 MEN1 (0.48) MEN1KMT2APOLBTDP1ALDH1A1
SCHEMBL8928339 0.88 MEN1 (0.48) MEN1KMT2APOLBTDP1ALDH1A1
SCHEMBL265122 0.87 MAPK1 (0.56) MEN1KMT2APOLBTDP1ALDH1A1
Methyl Alcohol SCHEMBL28201553 0.84 MEN1 (0.45) MEN1KMT2APOLBTDP1ALDH1A1
Alcohol SCHEMBL25236648 0.80 MEN1 (0.42) MEN1KMT2APOLBALDH1A1MAPK1
SCHEMBL3205552 0.76 TDP1 (0.74) MEN1KMT2APOLBTDP1ALDH1A1
SCHEMBL265235 0.74 CRHBP (0.55) MEN1KMT2APOLBTDP1ALDH1A1
SCHEMBL4867984 0.73 GPR35 (0.50) MEN1KMT2APOLBTDP1ALDH1A1
SCHEMBL5274045 0.73 TSHR (0.46) MEN1KMT2ATDP1ALDH1A1MAPK1
SCHEMBL7568232 0.73 GPR35 (0.53) MEN1KMT2APOLBTDP1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103852986-A Method for preparing printer toner by plasma-initiated polymerization UNIV JIXI 2014-06-11 CN claimed
CN-103852986-A Method for preparing printer toner by plasma-initiated polymerization UNIV JIXI 2014-06-11 CN disclosed