SCHEMBL8567128

SCHEMBL8567128

Nc1nc2ccccc2c(C=CCl)c1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
MGMT P16455 1/20 0.39
CYP3A4 P08684 1/20 0.38
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
KMT2A Q03164 6/20 0.36
MEN1 O00255 4/20 0.36
MAPK1 P28482 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTT P42858 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GLA P06280 2/20 0.36
LMNA P02545 3/20 0.36
HPGD P15428 2/20 0.36
DCPS Q96C86 1/20 0.36
XBP1 P17861 1/20 0.35
ALDH1A1 P00352 2/20 0.35
NPY1R P25929 1/20 0.35

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
SCHEMBL8567126 1.00 MAPT (0.39) MAPTMGMTCYP3A4RAB9ANPC1
SCHEMBL8562134 0.86 NFE2L2 (0.41) MAPTMGMTCYP3A4RAB9ANPC1
SCHEMBL8567366 0.82 KDM4E (0.40) MAPTCYP3A4RAB9ANPC1KMT2A
SCHEMBL8567364 0.82 KDM4E (0.40) MAPTCYP3A4RAB9ANPC1KMT2A
SCHEMBL8564990 0.80 MGMT (0.39) MAPTMGMTKMT2AMEN1MAPK1
SCHEMBL8564994 0.80 MGMT (0.39) MAPTMGMTKMT2AMEN1MAPK1
SCHEMBL8563099 0.79 ALDH1A1 (0.40) MAPTCYP3A4RAB9ANPC1KMT2A
SCHEMBL8563097 0.79 ALDH1A1 (0.40) MAPTCYP3A4RAB9ANPC1KMT2A
SCHEMBL8567950 0.79 CYP3A4 (0.47) MAPTMGMTCYP3A4RAB9AKMT2A
SCHEMBL12518927 0.78 MAOA (0.48) MAPTMGMTCYP3A4RAB9ANPC1

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