SCHEMBL8563242

SCHEMBL8563242

O=[N+]([O-])c1cc(C(F)(F)F)nc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.54
ADORA2A P29274 1/20 0.49
ADORA1 P30542 1/20 0.49
MAPT P10636 5/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
RAB9A P51151 2/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 4/20 0.46
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TLR7 Q9NYK1 1/20 0.46
ADRB2 P07550 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 2/20 0.45
HPRT1 P00492 1/20 0.45
ABCG2 Q9UNQ0 2/20 0.44
GUSB P08236 1/20 0.43
F2 P00734 1/20 0.43

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
SCHEMBL4824792 0.84 ALDH1A1 (0.62) IGF1RMAPTMEN1KMT2ARAB9A
SCHEMBL8560946 0.79 MEN1 (0.43) IGF1RMAPTMEN1KMT2ARAB9A
SCHEMBL3298254 0.78 KMT2A (0.54) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL8561151 0.77 BACE1 (0.51) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL8566524 0.77 MEN1 (0.53) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL483953 0.77 CTSB (0.50) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL28232869 0.77 ALDH1A1 (0.66) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL8562475 0.77 KMT2A (0.49) MAPTMEN1KMT2ARAB9AMAPK1
SCHEMBL2425904 0.76 ADORA2A (0.54) IGF1RADORA2AADORA1MAPTKMT2A
SCHEMBL2136947 0.75 MAPT (0.57) MAPTMEN1KMT2ARAB9AMAPK1

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