SCHEMBL8560840

SCHEMBL8560840

COCCc1cccnc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
S1PR4 O95977 2/20 0.46
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 1/20 0.45
HTT P42858 2/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
ESR2 Q92731 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 2/20 0.41
ATM Q13315 1/20 0.40
RECQL P46063 1/20 0.40
MCL1 Q07820 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL27504825 0.88 KMT2A (0.44) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL3158102 0.82 NPC1 (0.40) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL3142475 0.81 S1PR4 (0.63) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL27867259 0.79 KMT2A (0.56) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL27744819 0.79 NPC1 (0.40) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL4713894 0.79 S1PR4 (0.40) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL8568292 0.79 ALDH1A1 (0.39) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL27873051 0.79 KMT2A (0.41) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL3167072 0.79 KMT2A (0.41) KMT2AS1PR4ALDH1A1MEN1HTT
SCHEMBL29903448 0.79 KMT2A (0.41) KMT2AS1PR4ALDH1A1MEN1HTT

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