SCHEMBL9658765

SCHEMBL9658765

Nc1ccc(N=Nc2ccccc2[N+](=O)[O-])c([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 1/20 0.54
CCNB2 O95067 1/20 0.54
CCNE2 O96020 1/20 0.54
CDK1 P06493 1/20 0.54
CDK4 P11802 1/20 0.54
CCNB1 P14635 1/20 0.54
CCNA2 P20248 1/20 0.54
CCND1 P24385 1/20 0.54
CCNE1 P24864 1/20 0.54
CDK2 P24941 1/20 0.54
CDK7 P50613 1/20 0.54
CDK9 P50750 1/20 0.54
CCNH P51946 1/20 0.54
CCNA1 P78396 1/20 0.54
CCNB3 Q8WWL7 1/20 0.54
ALDH1A1 P00352 4/20 0.53
CYP3A4 P08684 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
ALOX15 P16050 2/20 0.53
PLAU P00749 1/20 0.51

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
SCHEMBL9658763 1.00 CCNT1 (0.54) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL8081714 0.89 ALOX15 (0.54) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL10868309 0.87 TDP1 (0.57) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL11043093 0.87 TDP1 (0.57) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL11456229 0.83 CCNT1 (0.54) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL11456230 0.83 CCNT1 (0.54) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL2003135 0.81 NPC1 (0.59) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL9006324 0.81 NPC1 (0.59) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL9506778 0.80 PTPN11 (0.52) CCNT1CCNB2CCNE2CDK1CDK4
SCHEMBL9506785 0.80 PTPN11 (0.52) CCNT1CCNB2CCNE2CDK1CDK4

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
EP-0504419-A1 PHOTOSENSITIVE AZO COMPOUND AND IMAGE FORMING DEVICE UTILIZING THE SAME SEIKO EPSON CORPORATION (JP) 1992-09-23 EP disclosed