SCHEMBL8560628

SCHEMBL8560628

Nc1ccnc(C2CC2F)c1[N+](=O)[O-]

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
KMT2A Q03164 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
MAPT P10636 3/20 0.33
HTT P42858 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MITF O75030 1/20 0.33
LMNA P02545 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MGMT P16455 1/20 0.31
NPY1R P25929 1/20 0.30
NOD2 Q9HC29 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL28232725 0.80 MEN1 (0.37) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL28232714 0.76 CDK2 (0.40) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL8563511 0.74 MKNK1 (0.36) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL8561310 0.73 KDM1A (0.34) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL28802588 0.72 MEN1 (0.41) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL18397997 0.71 MEN1 (0.35) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL3688848 0.71 MAPT (0.47) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL31302371 0.70 NPC1 (0.34) MAPTHTTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL18486948 0.70 KMT2A (0.42) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL8561095 0.70 MEN1 (0.42) MEN1USP2KMT2AKEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0735025-B1 Process for producing aminonitropyridines SUMITOMO CHEMICAL CO (JP) 1998-07-01 EP disclosed
US-5648496-A AMINATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-15 US disclosed
EP-0735025-A1 Process for producing aminonitropyridines SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed