SCHEMBL8567302

SCHEMBL8567302

Nc1cnc([N+](=O)[O-])c(C(=O)OCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.51
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 3/20 0.49
POLB P06746 1/20 0.45
TDP1 Q9NUW8 4/20 0.45
RXFP1 Q9HBX9 1/20 0.43
L3MBTL1 Q9Y468 5/20 0.43
TSHR P16473 2/20 0.43
PDE1C Q14123 1/20 0.43
HTT P42858 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
SLC6A2 P23975 1/20 0.42
SLC6A3 Q01959 1/20 0.42
MAPT P10636 1/20 0.42
ALKBH5 Q6P6C2 1/20 0.42
LMNA P02545 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41

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
SCHEMBL24414102 0.81 ALDH1A1 (0.51) RAB9AKMT2AALDH1A1POLBTDP1
SCHEMBL8564284 0.80 POLB (0.63) RAB9AKMT2AALDH1A1POLBTDP1
SCHEMBL8560654 0.79 RAB9A (0.52) RAB9AKMT2AALDH1A1POLBTDP1
SCHEMBL4619552 0.78 KMT2A (0.53) RAB9AKMT2AMAPT
SCHEMBL8566566 0.78 CYP1A2 (0.52) KMT2APOLBL3MBTL1HTTLMNA
SCHEMBL8560325 0.78 RAB9A (0.51) RAB9AKMT2AALDH1A1POLBTDP1
SCHEMBL8599426 0.76 ESR1 (0.48) RAB9AALDH1A1POLBTDP1L3MBTL1
SCHEMBL8563141 0.75 ALDH1A1 (0.44) KMT2AALDH1A1POLBTDP1L3MBTL1
SCHEMBL8568512 0.74 CA1 (0.41) KMT2AALDH1A1POLBMAPT
SCHEMBL8565798 0.74 RAB9A (0.55) RAB9AKMT2AALDH1A1POLBTDP1

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