SCHEMBL8567837

SCHEMBL8567837

O=[N+]([O-])c1cc(C2=NCCO2)nc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.40
MAPT P10636 7/20 0.40
MEN1 O00255 6/20 0.40
F2 P00734 1/20 0.40
C1R P00736 1/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 4/20 0.40
TDP1 Q9NUW8 3/20 0.39
TSHR P16473 1/20 0.39
THRB P10828 1/20 0.39
NPC1 O15118 2/20 0.39
POLB P06746 1/20 0.38
HPRT1 P00492 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GUSB P08236 1/20 0.38
PIM1 P11309 2/20 0.38
PIM3 Q86V86 2/20 0.38
CTSB P07858 1/20 0.38

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
SCHEMBL8564976 0.78 SMN1; SMN2 (0.39) KMT2AMAPTMEN1F2C1R
SCHEMBL2136947 0.77 MAPT (0.57) KMT2AMAPTMEN1RAB9ASMN1; SMN2
SCHEMBL8562399 0.75 POLB (0.43) KMT2AMAPTMEN1F2C1R
SCHEMBL8560848 0.73 ALDH1A1 (0.38) KMT2AMAPTMEN1F2C1R
SCHEMBL8568519 0.73 LMNA (0.36) KMT2AMAPTMEN1F2C1R
SCHEMBL8563739 0.73 KMT2A (0.36) KMT2AMAPTMEN1F2C1R
SCHEMBL4543383 0.73 ALDH1A1 (0.47) KMT2AMAPTMEN1F2C1R
SCHEMBL483628 0.71 MAPT (0.54) KMT2AMAPTMEN1RAB9ASMN1; SMN2
SCHEMBL12324217 0.71 MAPT (0.54) KMT2AMAPTMEN1RAB9ASMN1; SMN2
SCHEMBL3298254 0.70 KMT2A (0.54) KMT2AMAPTMEN1F2C1R

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